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PubMed code 8831770

Compile data set for download or QSAR
Found 136 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dopamine receptors; D2 & D4


(Homo sapiens (Human))
BDBM21398
PNG
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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PubMed
1n/an/an/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards human Dopamine receptor D4.2 in CHO cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM35254
PNG
(2-methyl-4-(4-methylpiperazin-1-yl)-10H-thieno[2,3...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Nc2sc(C)cc12
Show InChI InChI=1S/C17H20N4S/c1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12/h3-6,11,19H,7-10H2,1-2H3
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4n/an/an/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards human 5-HT2A receptor in BEK cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50053691
PNG
(3-{4-[4-(6-Fluoro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC1SC2(CCCC2)C(=O)N1CCCCN1CCN(CC1)c1csc2cc(F)ccc12
Show InChI InChI=1S/C24H32FN3OS2/c1-18-28(23(29)24(31-18)8-2-3-9-24)11-5-4-10-26-12-14-27(15-13-26)21-17-30-22-16-19(25)6-7-20(21)22/h6-7,16-18H,2-5,8-15H2,1H3
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4n/an/an/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards human 5-HT2A receptor in BEK cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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5n/an/an/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards human 5-HT2A receptor in BEK cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine receptors; D2 & D4


(Homo sapiens (Human))
BDBM50002107
PNG
(3-{4-[4-(6-Fluoro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC1SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1csc2cc(F)ccc12
Show InChI InChI=1S/C22H30FN3OS2/c1-16-26(21(27)22(2,3)29-16)9-5-4-8-24-10-12-25(13-11-24)19-15-28-20-14-17(23)6-7-18(19)20/h6-7,14-16H,4-5,8-13H2,1-3H3
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5n/an/an/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity against human Dopamine receptor D4.2 in CHO cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50002107
PNG
(3-{4-[4-(6-Fluoro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC1SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1csc2cc(F)ccc12
Show InChI InChI=1S/C22H30FN3OS2/c1-16-26(21(27)22(2,3)29-16)9-5-4-8-24-10-12-25(13-11-24)19-15-28-20-14-17(23)6-7-18(19)20/h6-7,14-16H,4-5,8-13H2,1-3H3
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8n/an/an/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards human 5-HT2A receptor in BEK cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine receptors; D2 & D4


(Homo sapiens (Human))
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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10n/an/an/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards human Dopamine receptor D4.2 in CHO cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine receptors; D2 & D4


(Homo sapiens (Human))
BDBM35254
PNG
(2-methyl-4-(4-methylpiperazin-1-yl)-10H-thieno[2,3...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Nc2sc(C)cc12
Show InChI InChI=1S/C17H20N4S/c1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12/h3-6,11,19H,7-10H2,1-2H3
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29n/an/an/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards human Dopamine receptor D4.2 in CHO cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM21398
PNG
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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108n/an/an/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards human 5-HT2A receptor in BEK cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine receptors; D2 & D4


(Homo sapiens (Human))
BDBM50053691
PNG
(3-{4-[4-(6-Fluoro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC1SC2(CCCC2)C(=O)N1CCCCN1CCN(CC1)c1csc2cc(F)ccc12
Show InChI InChI=1S/C24H32FN3OS2/c1-18-28(23(29)24(31-18)8-2-3-9-24)11-5-4-10-26-12-14-27(15-13-26)21-17-30-22-16-19(25)6-7-20(21)22/h6-7,16-18H,2-5,8-15H2,1H3
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117n/an/an/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity against human Dopamine receptor D4.2 in CHO cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053694
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES O=C1N(CCCCN2CCN(CC2)c2nsc3ccccc23)CSC11CCCC1
Show InChI InChI=1S/C22H30N4OS2/c27-21-22(9-3-4-10-22)28-17-26(21)12-6-5-11-24-13-15-25(16-14-24)20-18-7-1-2-8-19(18)29-23-20/h1-2,7-8H,3-6,9-17H2
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n/an/a 2n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053704
PNG
(3-{4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butyl}-...)
Show SMILES COc1ccccc1N1CCN(CCCCN2CSC3(CCCC3)C2=O)CC1
Show InChI InChI=1S/C22H33N3O2S/c1-27-20-9-3-2-8-19(20)24-16-14-23(15-17-24)12-6-7-13-25-18-28-22(21(25)26)10-4-5-11-22/h2-3,8-9H,4-7,10-18H2,1H3
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n/an/a 2n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053715
PNG
(3-[4-(4-Benzo[b]thiophen-3-yl-piperazin-1-yl)-buty...)
Show SMILES O=C1N(CCCCN2CCN(CC2)c2csc3ccccc23)CSC11CCCC1
Show InChI InChI=1S/C23H31N3OS2/c27-22-23(9-3-4-10-23)29-18-26(22)12-6-5-11-24-13-15-25(16-14-24)20-17-28-21-8-2-1-7-19(20)21/h1-2,7-8,17H,3-6,9-16,18H2
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n/an/a 2n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053700
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES O=C1N(CCCCN2CCN(CC2)c2nsc3ccccc23)CSC11CCCCC1
Show InChI InChI=1S/C23H32N4OS2/c28-22-23(10-4-1-5-11-23)29-18-27(22)13-7-6-12-25-14-16-26(17-15-25)21-19-8-2-3-9-20(19)30-24-21/h2-3,8-9H,1,4-7,10-18H2
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n/an/a 2n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053710
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES CC1SC2(CCCC2)C(=O)N1CCCCN1CCN(CC1)c1nsc2ccccc12
Show InChI InChI=1S/C23H32N4OS2/c1-18-27(22(28)23(29-18)10-4-5-11-23)13-7-6-12-25-14-16-26(17-15-25)21-19-8-2-3-9-20(19)30-24-21/h2-3,8-9,18H,4-7,10-17H2,1H3
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n/an/a 3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053728
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES FC(F)(F)CC1SCN(CCCCN2CCN(CC2)c2nsc3ccccc23)C1=O
Show InChI InChI=1S/C20H25F3N4OS2/c21-20(22,23)13-17-19(28)27(14-29-17)8-4-3-7-25-9-11-26(12-10-25)18-15-5-1-2-6-16(15)30-24-18/h1-2,5-6,17H,3-4,7-14H2
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n/an/a 3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine receptors; D2 & D4


(Homo sapiens (Human))
BDBM21398
PNG
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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n/an/a 6n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against human Dopamine receptor D4.2 in CHO cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053707
PNG
(3-{4-[4-(2,3-Dimethyl-phenyl)-piperazin-1-yl]-buty...)
Show SMILES Cc1cccc(N2CCN(CCCCN3CSC(C)(C)C3=O)CC2)c1C
Show InChI InChI=1S/C21H33N3OS/c1-17-8-7-9-19(18(17)2)23-14-12-22(13-15-23)10-5-6-11-24-16-26-21(3,4)20(24)25/h7-9H,5-6,10-16H2,1-4H3
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n/an/a 6n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053738
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES CC1(C)SCC(=O)N1CCCCN1CCN(CC1)c1nsc2ccccc12
Show InChI InChI=1S/C20H28N4OS2/c1-20(2)24(18(25)15-26-20)10-6-5-9-22-11-13-23(14-12-22)19-16-7-3-4-8-17(16)27-21-19/h3-4,7-8H,5-6,9-15H2,1-2H3
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n/an/a 7n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053714
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES CC1SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1nsc2ccccc12
Show InChI InChI=1S/C21H30N4OS2/c1-16-25(20(26)21(2,3)27-16)11-7-6-10-23-12-14-24(15-13-23)19-17-8-4-5-9-18(17)28-22-19/h4-5,8-9,16H,6-7,10-15H2,1-3H3
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n/an/a 7n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053736
PNG
(5,5-Dimethyl-3-{4-[4-(3-trifluoromethyl-phenyl)-pi...)
Show SMILES CC1(C)SCN(CCCCN2CCN(CC2)c2cccc(c2)C(F)(F)F)C1=O
Show InChI InChI=1S/C20H28F3N3OS/c1-19(2)18(27)26(15-28-19)9-4-3-8-24-10-12-25(13-11-24)17-7-5-6-16(14-17)20(21,22)23/h5-7,14H,3-4,8-13,15H2,1-2H3
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n/an/a 7n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50053691
PNG
(3-{4-[4-(6-Fluoro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC1SC2(CCCC2)C(=O)N1CCCCN1CCN(CC1)c1csc2cc(F)ccc12
Show InChI InChI=1S/C24H32FN3OS2/c1-18-28(23(29)24(31-18)8-2-3-9-24)11-5-4-10-26-12-14-27(15-13-26)21-17-30-22-16-19(25)6-7-20(21)22/h6-7,16-18H,2-5,8-15H2,1H3
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n/an/a 8n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against human 5-HT2A receptor in BEK cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053724
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES CC1(C)SCN(CCCCN2CCN(CC2)c2nsc3ccccc23)C1=O
Show InChI InChI=1S/C20H28N4OS2/c1-20(2)19(25)24(15-26-20)10-6-5-9-22-11-13-23(14-12-22)18-16-7-3-4-8-17(16)27-21-18/h3-4,7-8H,5-6,9-15H2,1-2H3
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n/an/a 8n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053731
PNG
(2,2-Dimethyl-3-{4-[4-(3-methylsulfanyl-phenyl)-pip...)
Show SMILES CSc1cccc(c1)N1CCN(CCCCN2C(=O)CSC2(C)C)CC1
Show InChI InChI=1S/C20H31N3OS2/c1-20(2)23(19(24)16-26-20)10-5-4-9-21-11-13-22(14-12-21)17-7-6-8-18(15-17)25-3/h6-8,15H,4-5,9-14,16H2,1-3H3
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n/an/a 9n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM35254
PNG
(2-methyl-4-(4-methylpiperazin-1-yl)-10H-thieno[2,3...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Nc2sc(C)cc12
Show InChI InChI=1S/C17H20N4S/c1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12/h3-6,11,19H,7-10H2,1-2H3
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n/an/a 9n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against human 5-HT2A receptor in BEK cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053745
PNG
(3-{4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butyl}-...)
Show SMILES COc1ccccc1N1CCN(CCCCN2C(=O)CSC2(C)C)CC1
Show InChI InChI=1S/C20H31N3O2S/c1-20(2)23(19(24)16-26-20)11-7-6-10-21-12-14-22(15-13-21)17-8-4-5-9-18(17)25-3/h4-5,8-9H,6-7,10-16H2,1-3H3
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n/an/a 10n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053721
PNG
(3-{4-[4-(3-Chloro-phenyl)-piperazin-1-yl]-butyl}-2...)
Show SMILES CC1SCC(=O)N1CCCCN1CCN(CC1)c1cccc(Cl)c1
Show InChI InChI=1S/C18H26ClN3OS/c1-15-22(18(23)14-24-15)8-3-2-7-20-9-11-21(12-10-20)17-6-4-5-16(19)13-17/h4-6,13,15H,2-3,7-12,14H2,1H3
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n/an/a 10n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053748
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES CC1SCN(CCCCN2CCN(CC2)c2nsc3ccccc23)C1=O
Show InChI InChI=1S/C19H26N4OS2/c1-15-19(24)23(14-25-15)9-5-4-8-21-10-12-22(13-11-21)18-16-6-2-3-7-17(16)26-20-18/h2-3,6-7,15H,4-5,8-14H2,1H3
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n/an/a 11n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053741
PNG
(3-{4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butyl}-...)
Show SMILES COc1ccccc1N1CCN(CCCCN2CSC(C)(C)C2=O)CC1
Show InChI InChI=1S/C20H31N3O2S/c1-20(2)19(24)23(16-26-20)11-7-6-10-21-12-14-22(15-13-21)17-8-4-5-9-18(17)25-3/h4-5,8-9H,6-7,10-16H2,1-3H3
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n/an/a 11n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053705
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES O=C1CSCN1CCCCN1CCN(CC1)c1nsc2ccccc12
Show InChI InChI=1S/C18H24N4OS2/c23-17-13-24-14-22(17)8-4-3-7-20-9-11-21(12-10-20)18-15-5-1-2-6-16(15)25-19-18/h1-2,5-6H,3-4,7-14H2
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n/an/a 11n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053749
PNG
(5,5-Dimethyl-3-[4-(4-m-tolyl-piperazin-1-yl)-butyl...)
Show SMILES Cc1cccc(c1)N1CCN(CCCCN2CSC(C)(C)C2=O)CC1
Show InChI InChI=1S/C20H31N3OS/c1-17-7-6-8-18(15-17)22-13-11-21(12-14-22)9-4-5-10-23-16-25-20(2,3)19(23)24/h6-8,15H,4-5,9-14,16H2,1-3H3
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n/an/a 12n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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n/an/a 12n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against human 5-HT2A receptor in BEK cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053689
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES CC(C)(O)C1SCN(CCCCN2CCN(CC2)c2nsc3ccccc23)C1=O
Show InChI InChI=1S/C21H30N4O2S2/c1-21(2,27)18-20(26)25(15-28-18)10-6-5-9-23-11-13-24(14-12-23)19-16-7-3-4-8-17(16)29-22-19/h3-4,7-8,18,27H,5-6,9-15H2,1-2H3
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n/an/a 12n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053733
PNG
(5,5-Dimethyl-3-[4-(4-o-tolyl-piperazin-1-yl)-butyl...)
Show SMILES Cc1ccccc1N1CCN(CCCCN2CSC(C)(C)C2=O)CC1
Show InChI InChI=1S/C20H31N3OS/c1-17-8-4-5-9-18(17)22-14-12-21(13-15-22)10-6-7-11-23-16-25-20(2,3)19(23)24/h4-5,8-9H,6-7,10-16H2,1-3H3
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n/an/a 13n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053708
PNG
(3-{4-[4-(6-Fluoro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC1(C)SCN(CCCCN2CCN(CC2)c2csc3cc(F)ccc23)C1=O
Show InChI InChI=1S/C21H28FN3OS2/c1-21(2)20(26)25(15-28-21)8-4-3-7-23-9-11-24(12-10-23)18-14-27-19-13-16(22)5-6-17(18)19/h5-6,13-14H,3-4,7-12,15H2,1-2H3
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n/an/a 14n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053694
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES O=C1N(CCCCN2CCN(CC2)c2nsc3ccccc23)CSC11CCCC1
Show InChI InChI=1S/C22H30N4OS2/c27-21-22(9-3-4-10-22)28-17-26(21)12-6-5-11-24-13-15-25(16-14-24)20-18-7-1-2-8-19(18)29-23-20/h1-2,7-8H,3-6,9-17H2
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n/an/a 16n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatal homogenate using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50002107
PNG
(3-{4-[4-(6-Fluoro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC1SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1csc2cc(F)ccc12
Show InChI InChI=1S/C22H30FN3OS2/c1-16-26(21(27)22(2,3)29-16)9-5-4-8-24-10-12-25(13-11-24)19-15-28-20-14-17(23)6-7-18(19)20/h6-7,14-16H,4-5,8-13H2,1-3H3
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n/an/a 17n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against human 5-HT2A receptor in BEK cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053742
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES CC1(C)SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1nsc2ccccc12
Show InChI InChI=1S/C22H32N4OS2/c1-21(2)20(27)26(22(3,4)29-21)12-8-7-11-24-13-15-25(16-14-24)19-17-9-5-6-10-18(17)28-23-19/h5-6,9-10H,7-8,11-16H2,1-4H3
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n/an/a 17n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053734
PNG
(3-{4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butyl}-...)
Show SMILES COc1ccccc1N1CCN(CCCCN2C(=O)C(C)(C)SC2(C)C)CC1
Show InChI InChI=1S/C22H35N3O2S/c1-21(2)20(26)25(22(3,4)28-21)13-9-8-12-23-14-16-24(17-15-23)18-10-6-7-11-19(18)27-5/h6-7,10-11H,8-9,12-17H2,1-5H3
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n/an/a 18n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053702
PNG
(3-(4-{4-[1-(4-Fluoro-phenyl)-1H-indol-3-yl]-pipera...)
Show SMILES Fc1ccc(cc1)-n1cc(N2CCN(CCCCN3CSC4(CCCCC4)C3=O)CC2)c2ccccc12
Show InChI InChI=1S/C30H37FN4OS/c31-24-10-12-25(13-11-24)35-22-28(26-8-2-3-9-27(26)35)33-20-18-32(19-21-33)16-6-7-17-34-23-37-30(29(34)36)14-4-1-5-15-30/h2-3,8-13,22H,1,4-7,14-21,23H2
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n/an/a 18n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053696
PNG
(3-{4-[4-(2-Chloro-phenyl)-piperazin-1-yl]-butyl}-t...)
Show SMILES Clc1ccccc1N1CCN(CCCCN2CSCC2=O)CC1
Show InChI InChI=1S/C17H24ClN3OS/c18-15-5-1-2-6-16(15)20-11-9-19(10-12-20)7-3-4-8-21-14-23-13-17(21)22/h1-2,5-6H,3-4,7-14H2
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n/an/a 23n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053744
PNG
(2,2-Dimethyl-3-[4-(4-m-tolyl-piperazin-1-yl)-butyl...)
Show SMILES Cc1cccc(c1)N1CCN(CCCCN2C(=O)CSC2(C)C)CC1
Show InChI InChI=1S/C20H31N3OS/c1-17-7-6-8-18(15-17)22-13-11-21(12-14-22)9-4-5-10-23-19(24)16-25-20(23,2)3/h6-8,15H,4-5,9-14,16H2,1-3H3
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n/an/a 26n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053689
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES CC(C)(O)C1SCN(CCCCN2CCN(CC2)c2nsc3ccccc23)C1=O
Show InChI InChI=1S/C21H30N4O2S2/c1-21(2,27)18-20(26)25(15-28-18)10-6-5-9-23-11-13-24(14-12-23)19-16-7-3-4-8-17(16)29-22-19/h3-4,7-8,18,27H,5-6,9-15H2,1-2H3
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n/an/a 29n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053700
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES O=C1N(CCCCN2CCN(CC2)c2nsc3ccccc23)CSC11CCCCC1
Show InChI InChI=1S/C23H32N4OS2/c28-22-23(10-4-1-5-11-23)29-18-27(22)13-7-6-12-25-14-16-26(17-15-25)21-19-8-2-3-9-20(19)30-24-21/h2-3,8-9H,1,4-7,10-18H2
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n/an/a 29n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatal homogenate using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine receptors; D2 & D4


(Homo sapiens (Human))
BDBM50002107
PNG
(3-{4-[4-(6-Fluoro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC1SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1csc2cc(F)ccc12
Show InChI InChI=1S/C22H30FN3OS2/c1-16-26(21(27)22(2,3)29-16)9-5-4-8-24-10-12-25(13-11-24)19-15-28-20-14-17(23)6-7-18(19)20/h6-7,14-16H,4-5,8-13H2,1-3H3
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n/an/a 29n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against human Dopamine receptor D4.2 in CHO cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM21398
PNG
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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n/an/a 33n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatal homogenate using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053727
PNG
(3-{4-[4-(3-Trifluoromethyl-phenyl)-piperazin-1-yl]...)
Show SMILES FC(F)(F)c1cccc(c1)N1CCN(CCCCN2CSCC2=O)CC1
Show InChI InChI=1S/C18H24F3N3OS/c19-18(20,21)15-4-3-5-16(12-15)23-10-8-22(9-11-23)6-1-2-7-24-14-26-13-17(24)25/h3-5,12H,1-2,6-11,13-14H2
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n/an/a 34n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50001885
PNG
((risperidone)3-{2-[4-(6-Fluoro-benzo[d]isoxazol-3-...)
Show SMILES Cc1nc2CCCCn2c(=O)c1CCN1CCC(CC1)c1noc2cc(F)ccc12
Show InChI InChI=1S/C23H27FN4O2/c1-15-18(23(29)28-10-3-2-4-21(28)25-15)9-13-27-11-7-16(8-12-27)22-19-6-5-17(24)14-20(19)30-26-22/h5-6,14,16H,2-4,7-13H2,1H3
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n/an/a 37n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053712
PNG
(2,2,5,5-Tetramethyl-3-[4-(4-m-tolyl-piperazin-1-yl...)
Show SMILES Cc1cccc(c1)N1CCN(CCCCN2C(=O)C(C)(C)SC2(C)C)CC1
Show InChI InChI=1S/C22H35N3OS/c1-18-9-8-10-19(17-18)24-15-13-23(14-16-24)11-6-7-12-25-20(26)21(2,3)27-22(25,4)5/h8-10,17H,6-7,11-16H2,1-5H3
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n/an/a 38n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053725
PNG
(3'-[4-(4-benzo[d]isothiazol-3-ylhexahydro-1-pyrazi...)
Show SMILES O=C1N(CCCCN2CCN(CC2)c2nsc3ccccc23)CSC11Cc2ccccc2C1
Show InChI InChI=1S/C26H30N4OS2/c31-25-26(17-20-7-1-2-8-21(20)18-26)32-19-30(25)12-6-5-11-28-13-15-29(16-14-28)24-22-9-3-4-10-23(22)33-27-24/h1-4,7-10H,5-6,11-19H2
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n/an/a 52n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053724
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES CC1(C)SCN(CCCCN2CCN(CC2)c2nsc3ccccc23)C1=O
Show InChI InChI=1S/C20H28N4OS2/c1-20(2)19(25)24(15-26-20)10-6-5-9-22-11-13-23(14-12-22)18-16-7-3-4-8-17(16)27-21-18/h3-4,7-8H,5-6,9-15H2,1-2H3
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n/an/a 55n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053703
PNG
(3-{4-[4-(3-Chloro-phenyl)-piperazin-1-yl]-butyl}-t...)
Show SMILES Clc1cccc(c1)N1CCN(CCCCN2CSCC2=O)CC1
Show InChI InChI=1S/C17H24ClN3OS/c18-15-4-3-5-16(12-15)20-10-8-19(9-11-20)6-1-2-7-21-14-23-13-17(21)22/h3-5,12H,1-2,6-11,13-14H2
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n/an/a 57n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine receptors; D2 & D4


(Homo sapiens (Human))
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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n/an/a 58n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against human Dopamine receptor D4.2 in CHO cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053709
PNG
(3-(4-{4-[1-(4-Fluoro-phenyl)-1H-indol-3-yl]-pipera...)
Show SMILES CC1SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1cn(-c2ccc(F)cc2)c2ccccc12
Show InChI InChI=1S/C28H35FN4OS/c1-21-32(27(34)28(2,3)35-21)15-7-6-14-30-16-18-31(19-17-30)26-20-33(23-12-10-22(29)11-13-23)25-9-5-4-8-24(25)26/h4-5,8-13,20-21H,6-7,14-19H2,1-3H3
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n/an/a 59n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50002107
PNG
(3-{4-[4-(6-Fluoro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC1SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1csc2cc(F)ccc12
Show InChI InChI=1S/C22H30FN3OS2/c1-16-26(21(27)22(2,3)29-16)9-5-4-8-24-10-12-25(13-11-24)19-15-28-20-14-17(23)6-7-18(19)20/h6-7,14-16H,4-5,8-13H2,1-3H3
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n/an/a 61n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053716
PNG
(3-[4-(4-o-Tolyl-piperazin-1-yl)-butyl]-thiazolidin...)
Show SMILES Cc1ccccc1N1CCN(CCCCN2CSCC2=O)CC1
Show InChI InChI=1S/C18H27N3OS/c1-16-6-2-3-7-17(16)20-12-10-19(11-13-20)8-4-5-9-21-15-23-14-18(21)22/h2-3,6-7H,4-5,8-15H2,1H3
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n/an/a 61n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053722
PNG
(3-{4-[4-(2,3-Dimethyl-phenyl)-piperazin-1-yl]-buty...)
Show SMILES Cc1cccc(N2CCN(CCCCN3CSCC3=O)CC2)c1C
Show InChI InChI=1S/C19H29N3OS/c1-16-6-5-7-18(17(16)2)21-12-10-20(11-13-21)8-3-4-9-22-15-24-14-19(22)23/h5-7H,3-4,8-15H2,1-2H3
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n/an/a 83n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053748
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES CC1SCN(CCCCN2CCN(CC2)c2nsc3ccccc23)C1=O
Show InChI InChI=1S/C19H26N4OS2/c1-15-19(24)23(14-25-15)9-5-4-8-21-10-12-22(13-11-21)18-16-6-2-3-7-17(16)26-20-18/h2-3,6-7,15H,4-5,8-14H2,1H3
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n/an/a 86n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053720
PNG
(3-{4-[4-(6-Fluoro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC(C)(O)C1SCN(CCCCN2CCN(CC2)c2csc3cc(F)ccc23)C1=O
Show InChI InChI=1S/C22H30FN3O2S2/c1-22(2,28)20-21(27)26(15-30-20)8-4-3-7-24-9-11-25(12-10-24)18-14-29-19-13-16(23)5-6-17(18)19/h5-6,13-14,20,28H,3-4,7-12,15H2,1-2H3
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n/an/a 91n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053730
PNG
(3-[4-(4-Benzo[b]thiophen-3-yl-piperazin-1-yl)-buty...)
Show SMILES O=C1N(CCCCN2CCN(CC2)c2csc3ccccc23)CSC11CCCCC1
Show InChI InChI=1S/C24H33N3OS2/c28-23-24(10-4-1-5-11-24)30-19-27(23)13-7-6-12-25-14-16-26(17-15-25)21-18-29-22-9-3-2-8-20(21)22/h2-3,8-9,18H,1,4-7,10-17,19H2
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n/an/a 102n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053695
PNG
(3-(4-{4-[1-(4-Fluoro-phenyl)-1H-indol-3-yl]-pipera...)
Show SMILES CC1(C)SCN(CCCCN2CCN(CC2)c2cn(-c3ccc(F)cc3)c3ccccc23)C1=O
Show InChI InChI=1S/C27H33FN4OS/c1-27(2)26(33)31(20-34-27)14-6-5-13-29-15-17-30(18-16-29)25-19-32(22-11-9-21(28)10-12-22)24-8-4-3-7-23(24)25/h3-4,7-12,19H,5-6,13-18,20H2,1-2H3
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n/an/a 131n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053728
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES FC(F)(F)CC1SCN(CCCCN2CCN(CC2)c2nsc3ccccc23)C1=O
Show InChI InChI=1S/C20H25F3N4OS2/c21-20(22,23)13-17-19(28)27(14-29-17)8-4-3-7-25-9-11-26(12-10-25)18-15-5-1-2-6-16(15)30-24-18/h1-2,5-6,17H,3-4,7-14H2
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n/an/a 136n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053726
PNG
(3-{4-[4-(3-Methoxy-phenyl)-piperazin-1-yl]-butyl}-...)
Show SMILES COc1cccc(c1)N1CCN(CCCCN2CSCC2=O)CC1
Show InChI InChI=1S/C18H27N3O2S/c1-23-17-6-4-5-16(13-17)20-11-9-19(10-12-20)7-2-3-8-21-15-24-14-18(21)22/h4-6,13H,2-3,7-12,14-15H2,1H3
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n/an/a 139n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053717
PNG
(3-{4-[4-(4-Fluoro-phenyl)-piperazin-1-yl]-butyl}-t...)
Show SMILES Fc1ccc(cc1)N1CCN(CCCCN2CSCC2=O)CC1
Show InChI InChI=1S/C17H24FN3OS/c18-15-3-5-16(6-4-15)20-11-9-19(10-12-20)7-1-2-8-21-14-23-13-17(21)22/h3-6H,1-2,7-14H2
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n/an/a 140n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053729
PNG
(3-[4-(4-m-Tolyl-piperazin-1-yl)-butyl]-thiazolidin...)
Show SMILES Cc1cccc(c1)N1CCN(CCCCN2CSCC2=O)CC1
Show InChI InChI=1S/C18H27N3OS/c1-16-5-4-6-17(13-16)20-11-9-19(10-12-20)7-2-3-8-21-15-23-14-18(21)22/h4-6,13H,2-3,7-12,14-15H2,1H3
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n/an/a 140n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053704
PNG
(3-{4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butyl}-...)
Show SMILES COc1ccccc1N1CCN(CCCCN2CSC3(CCCC3)C2=O)CC1
Show InChI InChI=1S/C22H33N3O2S/c1-27-20-9-3-2-8-19(20)24-16-14-23(15-17-24)12-6-7-13-25-18-28-22(21(25)26)10-4-5-11-22/h2-3,8-9H,4-7,10-18H2,1H3
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n/an/a 150n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053706
PNG
(5,5-Dimethyl-3-[4-(4-quinolin-2-yl-piperazin-1-yl)...)
Show SMILES CC1(C)SCN(CCCCN2CCN(CC2)c2ccc3ccccc3n2)C1=O
Show InChI InChI=1S/C22H30N4OS/c1-22(2)21(27)26(17-28-22)12-6-5-11-24-13-15-25(16-14-24)20-10-9-18-7-3-4-8-19(18)23-20/h3-4,7-10H,5-6,11-17H2,1-2H3
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n/an/a 153n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053710
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES CC1SC2(CCCC2)C(=O)N1CCCCN1CCN(CC1)c1nsc2ccccc12
Show InChI InChI=1S/C23H32N4OS2/c1-18-27(22(28)23(29-18)10-4-5-11-23)13-7-6-12-25-14-16-26(17-15-25)21-19-8-2-3-9-20(19)30-24-21/h2-3,8-9,18H,4-7,10-17H2,1H3
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n/an/a 154n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM35254
PNG
(2-methyl-4-(4-methylpiperazin-1-yl)-10H-thieno[2,3...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Nc2sc(C)cc12
Show InChI InChI=1S/C17H20N4S/c1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12/h3-6,11,19H,7-10H2,1-2H3
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n/an/a 158n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatal homogenate using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine receptors; D2 & D4


(Homo sapiens (Human))
BDBM35254
PNG
(2-methyl-4-(4-methylpiperazin-1-yl)-10H-thieno[2,3...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2Nc2sc(C)cc12
Show InChI InChI=1S/C17H20N4S/c1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12/h3-6,11,19H,7-10H2,1-2H3
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n/an/a 173n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against human Dopamine receptor D4.2 in CHO cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053691
PNG
(3-{4-[4-(6-Fluoro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC1SC2(CCCC2)C(=O)N1CCCCN1CCN(CC1)c1csc2cc(F)ccc12
Show InChI InChI=1S/C24H32FN3OS2/c1-18-28(23(29)24(31-18)8-2-3-9-24)11-5-4-10-26-12-14-27(15-13-26)21-17-30-22-16-19(25)6-7-20(21)22/h6-7,16-18H,2-5,8-15H2,1H3
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n/an/a 189n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053740
PNG
(5,5-Dimethyl-3-{4-[4-(1-phenyl-1H-indol-3-yl)-pipe...)
Show SMILES CC1(C)SCN(CCCCN2CCN(CC2)c2cn(-c3ccccc3)c3ccccc23)C1=O
Show InChI InChI=1S/C27H34N4OS/c1-27(2)26(32)30(21-33-27)15-9-8-14-28-16-18-29(19-17-28)25-20-31(22-10-4-3-5-11-22)24-13-7-6-12-23(24)25/h3-7,10-13,20H,8-9,14-19,21H2,1-2H3
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n/an/a 191n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053738
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES CC1(C)SCC(=O)N1CCCCN1CCN(CC1)c1nsc2ccccc12
Show InChI InChI=1S/C20H28N4OS2/c1-20(2)24(18(25)15-26-20)10-6-5-9-22-11-13-23(14-12-22)19-16-7-3-4-8-17(16)27-21-19/h3-4,7-8H,5-6,9-15H2,1-2H3
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n/an/a 193n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053737
PNG
(2,5,5-Trimethyl-3-{4-[4-(1-phenyl-1H-indol-3-yl)-p...)
Show SMILES CC1SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1cn(-c2ccccc2)c2ccccc12
Show InChI InChI=1S/C28H36N4OS/c1-22-31(27(33)28(2,3)34-22)16-10-9-15-29-17-19-30(20-18-29)26-21-32(23-11-5-4-6-12-23)25-14-8-7-13-24(25)26/h4-8,11-14,21-22H,9-10,15-20H2,1-3H3
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n/an/a 200n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053742
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES CC1(C)SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1nsc2ccccc12
Show InChI InChI=1S/C22H32N4OS2/c1-21(2)20(27)26(22(3,4)29-21)12-8-7-11-24-13-15-25(16-14-24)19-17-9-5-6-10-18(17)28-23-19/h5-6,9-10H,7-8,11-16H2,1-4H3
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n/an/a 201n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053730
PNG
(3-[4-(4-Benzo[b]thiophen-3-yl-piperazin-1-yl)-buty...)
Show SMILES O=C1N(CCCCN2CCN(CC2)c2csc3ccccc23)CSC11CCCCC1
Show InChI InChI=1S/C24H33N3OS2/c28-23-24(10-4-1-5-11-24)30-19-27(23)13-7-6-12-25-14-16-26(17-15-25)21-18-29-22-9-3-2-8-20(21)22/h2-3,8-9,18H,1,4-7,10-17,19H2
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n/an/a 218n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053699
PNG
(3-{4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butyl}-...)
Show SMILES COc1ccccc1N1CCN(CCCCN2CSC(C)C2=O)CC1
Show InChI InChI=1S/C19H29N3O2S/c1-16-19(23)22(15-25-16)10-6-5-9-20-11-13-21(14-12-20)17-7-3-4-8-18(17)24-2/h3-4,7-8,16H,5-6,9-15H2,1-2H3
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n/an/a 220n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053705
PNG
(3-[4-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-bu...)
Show SMILES O=C1CSCN1CCCCN1CCN(CC1)c1nsc2ccccc12
Show InChI InChI=1S/C18H24N4OS2/c23-17-13-24-14-22(17)8-4-3-7-20-9-11-21(12-10-20)18-15-5-1-2-6-16(15)25-19-18/h1-2,5-6H,3-4,7-14H2
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n/an/a 224n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053715
PNG
(3-[4-(4-Benzo[b]thiophen-3-yl-piperazin-1-yl)-buty...)
Show SMILES O=C1N(CCCCN2CCN(CC2)c2csc3ccccc23)CSC11CCCC1
Show InChI InChI=1S/C23H31N3OS2/c27-22-23(9-3-4-10-23)29-18-26(22)12-6-5-11-24-13-15-25(16-14-24)20-17-28-21-8-2-1-7-19(20)21/h1-2,7-8,17H,3-6,9-16,18H2
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n/an/a 244n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053746
PNG
(3-{4-[4-(6-Chloro-benzo[d]isothiazol-3-yl)-piperaz...)
Show SMILES CC1SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1nsc2cc(Cl)ccc12
Show InChI InChI=1S/C21H29ClN4OS2/c1-15-26(20(27)21(2,3)28-15)9-5-4-8-24-10-12-25(13-11-24)19-17-7-6-16(22)14-18(17)29-23-19/h6-7,14-15H,4-5,8-13H2,1-3H3
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n/an/a 286n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM21398
PNG
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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n/an/a 288n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against human 5-HT2A receptor in BEK cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053734
PNG
(3-{4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butyl}-...)
Show SMILES COc1ccccc1N1CCN(CCCCN2C(=O)C(C)(C)SC2(C)C)CC1
Show InChI InChI=1S/C22H35N3O2S/c1-21(2)20(26)25(22(3,4)28-21)13-9-8-12-23-14-16-24(17-15-23)18-10-6-7-11-19(18)27-5/h6-7,10-11H,8-9,12-17H2,1-5H3
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n/an/a 304n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatal homogenate using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053746
PNG
(3-{4-[4-(6-Chloro-benzo[d]isothiazol-3-yl)-piperaz...)
Show SMILES CC1SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1nsc2cc(Cl)ccc12
Show InChI InChI=1S/C21H29ClN4OS2/c1-15-26(20(27)21(2,3)28-15)9-5-4-8-24-10-12-25(13-11-24)19-17-7-6-16(22)14-18(17)29-23-19/h6-7,14-15H,4-5,8-13H2,1-3H3
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n/an/a 324n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053701
PNG
(3-[4-(4-Quinolin-2-yl-piperazin-1-yl)-butyl]-thiaz...)
Show SMILES O=C1CSCN1CCCCN1CCN(CC1)c1ccc2ccccc2n1
Show InChI InChI=1S/C20H26N4OS/c25-20-15-26-16-24(20)10-4-3-9-22-11-13-23(14-12-22)19-8-7-17-5-1-2-6-18(17)21-19/h1-2,5-8H,3-4,9-16H2
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n/an/a 332n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053698
PNG
(2-Methyl-3-{4-[4-(1-phenyl-1H-indol-3-yl)-piperazi...)
Show SMILES CC1SC2(CCCC2)C(=O)N1CCCCN1CCN(CC1)c1cn(-c2ccccc2)c2ccccc12
Show InChI InChI=1S/C30H38N4OS/c1-24-33(29(35)30(36-24)15-7-8-16-30)18-10-9-17-31-19-21-32(22-20-31)28-23-34(25-11-3-2-4-12-25)27-14-6-5-13-26(27)28/h2-6,11-14,23-24H,7-10,15-22H2,1H3
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n/an/a 356n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053735
PNG
(3-[4-(4-Benzothiazol-2-yl-piperazin-1-yl)-butyl]-t...)
Show SMILES O=C1CSCN1CCCCN1CCN(CC1)c1nc2ccccc2s1
Show InChI InChI=1S/C18H24N4OS2/c23-17-13-24-14-22(17)8-4-3-7-20-9-11-21(12-10-20)18-19-15-5-1-2-6-16(15)25-18/h1-2,5-6H,3-4,7-14H2
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n/an/a 367n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053720
PNG
(3-{4-[4-(6-Fluoro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC(C)(O)C1SCN(CCCCN2CCN(CC2)c2csc3cc(F)ccc23)C1=O
Show InChI InChI=1S/C22H30FN3O2S2/c1-22(2,28)20-21(27)26(15-30-20)8-4-3-7-24-9-11-25(12-10-24)18-14-29-19-13-16(23)5-6-17(18)19/h5-6,13-14,20,28H,3-4,7-12,15H2,1-2H3
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n/an/a 453n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053747
PNG
(3-{4-[4-(1-Phenyl-1H-indol-3-yl)-piperazin-1-yl]-b...)
Show SMILES O=C1N(CCCCN2CCN(CC2)c2cn(-c3ccccc3)c3ccccc23)CSC11CCCCC1
Show InChI InChI=1S/C30H38N4OS/c35-29-30(15-7-2-8-16-30)36-24-33(29)18-10-9-17-31-19-21-32(22-20-31)28-23-34(25-11-3-1-4-12-25)27-14-6-5-13-26(27)28/h1,3-6,11-14,23H,2,7-10,15-22,24H2
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n/an/a 467n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053745
PNG
(3-{4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butyl}-...)
Show SMILES COc1ccccc1N1CCN(CCCCN2C(=O)CSC2(C)C)CC1
Show InChI InChI=1S/C20H31N3O2S/c1-20(2)23(19(24)16-26-20)11-7-6-10-21-12-14-22(15-13-21)17-8-4-5-9-18(17)25-3/h4-5,8-9H,6-7,10-16H2,1-3H3
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n/an/a 514n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053741
PNG
(3-{4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butyl}-...)
Show SMILES COc1ccccc1N1CCN(CCCCN2CSC(C)(C)C2=O)CC1
Show InChI InChI=1S/C20H31N3O2S/c1-20(2)19(24)23(16-26-20)11-7-6-10-21-12-14-22(15-13-21)17-8-4-5-9-18(17)25-3/h4-5,8-9H,6-7,10-16H2,1-3H3
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n/an/a 548n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053732
PNG
(3-{4-[4-(6-Chloro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC1SC2(CCCC2)C(=O)N1CCCCN1CCN(CC1)c1csc2cc(Cl)ccc12
Show InChI InChI=1S/C24H32ClN3OS2/c1-18-28(23(29)24(31-18)8-2-3-9-24)11-5-4-10-26-12-14-27(15-13-26)21-17-30-22-16-19(25)6-7-20(21)22/h6-7,16-18H,2-5,8-15H2,1H3
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n/an/a 611n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053713
PNG
(3-[4-(4-Isoquinolin-3-yl-piperazin-1-yl)-butyl]-5,...)
Show SMILES CC1(C)SCN(CCCCN2CCN(CC2)c2cc3ccccc3cn2)C1=O
Show InChI InChI=1S/C22H30N4OS/c1-22(2)21(27)26(17-28-22)10-6-5-9-24-11-13-25(14-12-24)20-15-18-7-3-4-8-19(18)16-23-20/h3-4,7-8,15-16H,5-6,9-14,17H2,1-2H3
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n/an/a 629n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053696
PNG
(3-{4-[4-(2-Chloro-phenyl)-piperazin-1-yl]-butyl}-t...)
Show SMILES Clc1ccccc1N1CCN(CCCCN2CSCC2=O)CC1
Show InChI InChI=1S/C17H24ClN3OS/c18-15-5-1-2-6-16(15)20-11-9-19(10-12-20)7-3-4-8-21-14-23-13-17(21)22/h1-2,5-6H,3-4,7-14H2
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n/an/a 652n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053723
PNG
(3-{4-[4-(6-Chloro-benzo[d]isothiazol-3-yl)-piperaz...)
Show SMILES Clc1ccc2c(nsc2c1)N1CCN(CCCCN2CSC3(CCCCC3)C2=O)CC1
Show InChI InChI=1S/C23H31ClN4OS2/c24-18-6-7-19-20(16-18)31-25-21(19)27-14-12-26(13-15-27)10-4-5-11-28-17-30-23(22(28)29)8-2-1-3-9-23/h6-7,16H,1-5,8-15,17H2
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n/an/a 671n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053725
PNG
(3'-[4-(4-benzo[d]isothiazol-3-ylhexahydro-1-pyrazi...)
Show SMILES O=C1N(CCCCN2CCN(CC2)c2nsc3ccccc23)CSC11Cc2ccccc2C1
Show InChI InChI=1S/C26H30N4OS2/c31-25-26(17-20-7-1-2-8-21(20)18-26)32-19-30(25)12-6-5-11-28-13-15-29(16-14-28)24-22-9-3-4-10-23(22)33-27-24/h1-4,7-10H,5-6,11-19H2
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n/an/a 697n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine receptors; D2 & D4


(Homo sapiens (Human))
BDBM50053691
PNG
(3-{4-[4-(6-Fluoro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC1SC2(CCCC2)C(=O)N1CCCCN1CCN(CC1)c1csc2cc(F)ccc12
Show InChI InChI=1S/C24H32FN3OS2/c1-18-28(23(29)24(31-18)8-2-3-9-24)11-5-4-10-26-12-14-27(15-13-26)21-17-30-22-16-19(25)6-7-20(21)22/h6-7,16-18H,2-5,8-15H2,1H3
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n/an/a 713n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Inhibitory concentration against human Dopamine receptor D4.2 in CHO cells


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053732
PNG
(3-{4-[4-(6-Chloro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC1SC2(CCCC2)C(=O)N1CCCCN1CCN(CC1)c1csc2cc(Cl)ccc12
Show InChI InChI=1S/C24H32ClN3OS2/c1-18-28(23(29)24(31-18)8-2-3-9-24)11-5-4-10-26-12-14-27(15-13-26)21-17-30-22-16-19(25)6-7-20(21)22/h6-7,16-18H,2-5,8-15H2,1H3
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n/an/a 776n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053722
PNG
(3-{4-[4-(2,3-Dimethyl-phenyl)-piperazin-1-yl]-buty...)
Show SMILES Cc1cccc(N2CCN(CCCCN3CSCC3=O)CC2)c1C
Show InChI InChI=1S/C19H29N3OS/c1-16-6-5-7-18(17(16)2)21-12-10-20(11-13-21)8-3-4-9-22-15-24-14-19(22)23/h5-7H,3-4,8-15H2,1-2H3
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n/an/a 778n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053699
PNG
(3-{4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butyl}-...)
Show SMILES COc1ccccc1N1CCN(CCCCN2CSC(C)C2=O)CC1
Show InChI InChI=1S/C19H29N3O2S/c1-16-19(23)22(15-25-16)10-6-5-9-20-11-13-21(14-12-20)17-7-3-4-8-18(17)24-2/h3-4,7-8,16H,5-6,9-15H2,1-2H3
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n/an/a 786n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053697
PNG
(3-{4-[4-(3-Chloro-phenyl)-piperazin-1-yl]-butyl}-2...)
Show SMILES CC1(C)SCC(=O)N1CCCCN1CCN(CC1)c1cccc(Cl)c1
Show InChI InChI=1S/C19H28ClN3OS/c1-19(2)23(18(24)15-25-19)9-4-3-8-21-10-12-22(13-11-21)17-7-5-6-16(20)14-17/h5-7,14H,3-4,8-13,15H2,1-2H3
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n/an/a 835n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053743
PNG
(3-{4-[4-(6-Chloro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC1SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1csc2cc(Cl)ccc12
Show InChI InChI=1S/C22H30ClN3OS2/c1-16-26(21(27)22(2,3)29-16)9-5-4-8-24-10-12-25(13-11-24)19-15-28-20-14-17(23)6-7-18(19)20/h6-7,14-16H,4-5,8-13H2,1-3H3
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n/an/a 855n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053707
PNG
(3-{4-[4-(2,3-Dimethyl-phenyl)-piperazin-1-yl]-buty...)
Show SMILES Cc1cccc(N2CCN(CCCCN3CSC(C)(C)C3=O)CC2)c1C
Show InChI InChI=1S/C21H33N3OS/c1-17-8-7-9-19(18(17)2)23-14-12-22(13-15-23)10-5-6-11-24-16-26-21(3,4)20(24)25/h7-9H,5-6,10-16H2,1-4H3
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n/an/a 916n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50001885
PNG
((risperidone)3-{2-[4-(6-Fluoro-benzo[d]isoxazol-3-...)
Show SMILES Cc1nc2CCCCn2c(=O)c1CCN1CCC(CC1)c1noc2cc(F)ccc12
Show InChI InChI=1S/C23H27FN4O2/c1-15-18(23(29)28-10-3-2-4-21(28)25-15)9-13-27-11-7-16(8-12-27)22-19-6-5-17(24)14-20(19)30-26-22/h5-6,14,16H,2-4,7-13H2,1H3
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n/an/a 950n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053691
PNG
(3-{4-[4-(6-Fluoro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC1SC2(CCCC2)C(=O)N1CCCCN1CCN(CC1)c1csc2cc(F)ccc12
Show InChI InChI=1S/C24H32FN3OS2/c1-18-28(23(29)24(31-18)8-2-3-9-24)11-5-4-10-26-12-14-27(15-13-26)21-17-30-22-16-19(25)6-7-20(21)22/h6-7,16-18H,2-5,8-15H2,1H3
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n/an/a 954n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053723
PNG
(3-{4-[4-(6-Chloro-benzo[d]isothiazol-3-yl)-piperaz...)
Show SMILES Clc1ccc2c(nsc2c1)N1CCN(CCCCN2CSC3(CCCCC3)C2=O)CC1
Show InChI InChI=1S/C23H31ClN4OS2/c24-18-6-7-19-20(16-18)31-25-21(19)27-14-12-26(13-15-27)10-4-5-11-28-17-30-23(22(28)29)8-2-1-3-9-23/h6-7,16H,1-5,8-15,17H2
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n/an/a 969n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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n/an/a 1.01E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053718
PNG
(3-{4-[4-(6-Fluoro-1-phenyl-1H-indol-3-yl)-piperazi...)
Show SMILES CC1SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1cn(-c2ccccc2)c2cc(F)ccc12
Show InChI InChI=1S/C28H35FN4OS/c1-21-32(27(34)28(2,3)35-21)14-8-7-13-30-15-17-31(18-16-30)26-20-33(23-9-5-4-6-10-23)25-19-22(29)11-12-24(25)26/h4-6,9-12,19-21H,7-8,13-18H2,1-3H3
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n/an/a 1.09E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053719
PNG
(2,2-Dimethyl-3-{4-[4-(3-trifluoromethyl-phenyl)-pi...)
Show SMILES CC1(C)SCC(=O)N1CCCCN1CCN(CC1)c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C20H28F3N3OS/c1-19(2)26(18(27)15-28-19)9-4-3-8-24-10-12-25(13-11-24)17-7-5-6-16(14-17)20(21,22)23/h5-7,14H,3-4,8-13,15H2,1-2H3
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n/an/a 1.13E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50002107
PNG
(3-{4-[4-(6-Fluoro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC1SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1csc2cc(F)ccc12
Show InChI InChI=1S/C22H30FN3OS2/c1-16-26(21(27)22(2,3)29-16)9-5-4-8-24-10-12-25(13-11-24)19-15-28-20-14-17(23)6-7-18(19)20/h6-7,14-16H,4-5,8-13H2,1-3H3
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n/an/a 1.21E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053693
PNG
(3-{4-[4-(4-Chloro-phenyl)-piperazin-1-yl]-butyl}-t...)
Show SMILES Clc1ccc(cc1)N1CCN(CCCCN2CSCC2=O)CC1
Show InChI InChI=1S/C17H24ClN3OS/c18-15-3-5-16(6-4-15)20-11-9-19(10-12-20)7-1-2-8-21-14-23-13-17(21)22/h3-6H,1-2,7-14H2
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n/an/a 1.28E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053692
PNG
(3-[4-(4-Benzothiazol-2-yl-piperazin-1-yl)-butyl]-5...)
Show SMILES CC1(C)SCN(CCCCN2CCN(CC2)c2nc3ccccc3s2)C1=O
Show InChI InChI=1S/C20H28N4OS2/c1-20(2)18(25)24(15-26-20)10-6-5-9-22-11-13-23(14-12-22)19-21-16-7-3-4-8-17(16)27-19/h3-4,7-8H,5-6,9-15H2,1-2H3
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n/an/a 1.37E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053716
PNG
(3-[4-(4-o-Tolyl-piperazin-1-yl)-butyl]-thiazolidin...)
Show SMILES Cc1ccccc1N1CCN(CCCCN2CSCC2=O)CC1
Show InChI InChI=1S/C18H27N3OS/c1-16-6-2-3-7-17(16)20-12-10-19(11-13-20)8-4-5-9-21-15-23-14-18(21)22/h2-3,6-7H,4-5,8-15H2,1H3
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n/an/a 1.61E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50001884
PNG
(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2Nc2ccccc12
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
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n/an/a 1.61E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatal homogenate using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053736
PNG
(5,5-Dimethyl-3-{4-[4-(3-trifluoromethyl-phenyl)-pi...)
Show SMILES CC1(C)SCN(CCCCN2CCN(CC2)c2cccc(c2)C(F)(F)F)C1=O
Show InChI InChI=1S/C20H28F3N3OS/c1-19(2)18(27)26(15-28-19)9-4-3-8-24-10-12-25(13-11-24)17-7-5-6-16(14-17)20(21,22)23/h5-7,14H,3-4,8-13,15H2,1-2H3
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n/an/a 1.64E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053740
PNG
(5,5-Dimethyl-3-{4-[4-(1-phenyl-1H-indol-3-yl)-pipe...)
Show SMILES CC1(C)SCN(CCCCN2CCN(CC2)c2cn(-c3ccccc3)c3ccccc23)C1=O
Show InChI InChI=1S/C27H34N4OS/c1-27(2)26(32)30(21-33-27)15-9-8-14-28-16-18-29(19-17-28)25-20-31(22-10-4-3-5-11-22)24-13-7-6-12-23(24)25/h3-7,10-13,20H,8-9,14-19,21H2,1-2H3
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n/an/a 1.73E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053733
PNG
(5,5-Dimethyl-3-[4-(4-o-tolyl-piperazin-1-yl)-butyl...)
Show SMILES Cc1ccccc1N1CCN(CCCCN2CSC(C)(C)C2=O)CC1
Show InChI InChI=1S/C20H31N3OS/c1-17-8-4-5-9-18(17)22-14-12-21(13-15-22)10-6-7-11-23-16-25-20(2,3)19(23)24/h4-5,8-9H,6-7,10-16H2,1-3H3
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n/an/a 1.77E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053712
PNG
(2,2,5,5-Tetramethyl-3-[4-(4-m-tolyl-piperazin-1-yl...)
Show SMILES Cc1cccc(c1)N1CCN(CCCCN2C(=O)C(C)(C)SC2(C)C)CC1
Show InChI InChI=1S/C22H35N3OS/c1-18-9-8-10-19(17-18)24-15-13-23(14-16-24)11-6-7-12-25-20(26)21(2,3)27-22(25,4)5/h8-10,17H,6-7,11-16H2,1-5H3
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n/an/a 1.84E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053727
PNG
(3-{4-[4-(3-Trifluoromethyl-phenyl)-piperazin-1-yl]...)
Show SMILES FC(F)(F)c1cccc(c1)N1CCN(CCCCN2CSCC2=O)CC1
Show InChI InChI=1S/C18H24F3N3OS/c19-18(20,21)15-4-3-5-16(12-15)23-10-8-22(9-11-23)6-1-2-7-24-14-26-13-17(24)25/h3-5,12H,1-2,6-11,13-14H2
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n/an/a 1.96E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053703
PNG
(3-{4-[4-(3-Chloro-phenyl)-piperazin-1-yl]-butyl}-t...)
Show SMILES Clc1cccc(c1)N1CCN(CCCCN2CSCC2=O)CC1
Show InChI InChI=1S/C17H24ClN3OS/c18-15-4-3-5-16(12-15)20-10-8-19(9-11-20)6-1-2-7-21-14-23-13-17(21)22/h3-5,12H,1-2,6-11,13-14H2
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n/an/a 2.21E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053721
PNG
(3-{4-[4-(3-Chloro-phenyl)-piperazin-1-yl]-butyl}-2...)
Show SMILES CC1SCC(=O)N1CCCCN1CCN(CC1)c1cccc(Cl)c1
Show InChI InChI=1S/C18H26ClN3OS/c1-15-22(18(23)14-24-15)8-3-2-7-20-9-11-21(12-10-20)17-6-4-5-16(19)13-17/h4-6,13,15H,2-3,7-12,14H2,1H3
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n/an/a 2.23E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053695
PNG
(3-(4-{4-[1-(4-Fluoro-phenyl)-1H-indol-3-yl]-pipera...)
Show SMILES CC1(C)SCN(CCCCN2CCN(CC2)c2cn(-c3ccc(F)cc3)c3ccccc23)C1=O
Show InChI InChI=1S/C27H33FN4OS/c1-27(2)26(33)31(20-34-27)14-6-5-13-29-15-17-30(18-16-29)25-19-32(22-11-9-21(28)10-12-22)24-8-4-3-7-23(24)25/h3-4,7-12,19H,5-6,13-18,20H2,1-2H3
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n/an/a 2.33E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053731
PNG
(2,2-Dimethyl-3-{4-[4-(3-methylsulfanyl-phenyl)-pip...)
Show SMILES CSc1cccc(c1)N1CCN(CCCCN2C(=O)CSC2(C)C)CC1
Show InChI InChI=1S/C20H31N3OS2/c1-20(2)23(19(24)16-26-20)10-5-4-9-21-11-13-22(14-12-21)17-7-6-8-18(15-17)25-3/h6-8,15H,4-5,9-14,16H2,1-3H3
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n/an/a 2.43E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053737
PNG
(2,5,5-Trimethyl-3-{4-[4-(1-phenyl-1H-indol-3-yl)-p...)
Show SMILES CC1SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1cn(-c2ccccc2)c2ccccc12
Show InChI InChI=1S/C28H36N4OS/c1-22-31(27(33)28(2,3)34-22)16-10-9-15-29-17-19-30(20-18-29)26-21-32(23-11-5-4-6-12-23)25-14-8-7-13-24(25)26/h4-8,11-14,21-22H,9-10,15-20H2,1-3H3
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n/an/a 2.55E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053749
PNG
(5,5-Dimethyl-3-[4-(4-m-tolyl-piperazin-1-yl)-butyl...)
Show SMILES Cc1cccc(c1)N1CCN(CCCCN2CSC(C)(C)C2=O)CC1
Show InChI InChI=1S/C20H31N3OS/c1-17-7-6-8-18(15-17)22-13-11-21(12-14-22)9-4-5-10-23-16-25-20(2,3)19(23)24/h6-8,15H,4-5,9-14,16H2,1-3H3
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n/an/a 2.64E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053709
PNG
(3-(4-{4-[1-(4-Fluoro-phenyl)-1H-indol-3-yl]-pipera...)
Show SMILES CC1SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1cn(-c2ccc(F)cc2)c2ccccc12
Show InChI InChI=1S/C28H35FN4OS/c1-21-32(27(34)28(2,3)35-21)15-7-6-14-30-16-18-31(19-17-30)26-20-33(23-12-10-22(29)11-13-23)25-9-5-4-8-24(25)26/h4-5,8-13,20-21H,6-7,14-19H2,1-3H3
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n/an/a 3.05E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053744
PNG
(2,2-Dimethyl-3-[4-(4-m-tolyl-piperazin-1-yl)-butyl...)
Show SMILES Cc1cccc(c1)N1CCN(CCCCN2C(=O)CSC2(C)C)CC1
Show InChI InChI=1S/C20H31N3OS/c1-17-7-6-8-18(15-17)22-13-11-21(12-14-22)9-4-5-10-23-19(24)16-25-20(23,2)3/h6-8,15H,4-5,9-14,16H2,1-3H3
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n/an/a 3.75E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053743
PNG
(3-{4-[4-(6-Chloro-benzo[b]thiophen-3-yl)-piperazin...)
Show SMILES CC1SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1csc2cc(Cl)ccc12
Show InChI InChI=1S/C22H30ClN3OS2/c1-16-26(21(27)22(2,3)29-16)9-5-4-8-24-10-12-25(13-11-24)19-15-28-20-14-17(23)6-7-18(19)20/h6-7,14-16H,4-5,8-13H2,1-3H3
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n/an/a 4.73E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM21398
PNG
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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n/an/a 7.08E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053726
PNG
(3-{4-[4-(3-Methoxy-phenyl)-piperazin-1-yl]-butyl}-...)
Show SMILES COc1cccc(c1)N1CCN(CCCCN2CSCC2=O)CC1
Show InChI InChI=1S/C18H27N3O2S/c1-23-17-6-4-5-16(13-17)20-11-9-19(10-12-20)7-2-3-8-21-15-24-14-18(21)22/h4-6,13H,2-3,7-12,14-15H2,1H3
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n/an/a 7.49E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053718
PNG
(3-{4-[4-(6-Fluoro-1-phenyl-1H-indol-3-yl)-piperazi...)
Show SMILES CC1SC(C)(C)C(=O)N1CCCCN1CCN(CC1)c1cn(-c2ccccc2)c2cc(F)ccc12
Show InChI InChI=1S/C28H35FN4OS/c1-21-32(27(34)28(2,3)35-21)14-8-7-13-30-15-17-31(18-16-30)26-20-33(23-9-5-4-6-10-23)25-19-22(29)11-12-24(25)26/h4-6,9-12,19-21H,7-8,13-18H2,1-3H3
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n/an/a 8.08E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053713
PNG
(3-[4-(4-Isoquinolin-3-yl-piperazin-1-yl)-butyl]-5,...)
Show SMILES CC1(C)SCN(CCCCN2CCN(CC2)c2cc3ccccc3cn2)C1=O
Show InChI InChI=1S/C22H30N4OS/c1-22(2)21(27)26(17-28-22)10-6-5-9-24-11-13-25(14-12-24)20-15-18-7-3-4-8-19(18)16-23-20/h3-4,7-8,15-16H,5-6,9-14,17H2,1-2H3
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n/an/a 8.43E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053693
PNG
(3-{4-[4-(4-Chloro-phenyl)-piperazin-1-yl]-butyl}-t...)
Show SMILES Clc1ccc(cc1)N1CCN(CCCCN2CSCC2=O)CC1
Show InChI InChI=1S/C17H24ClN3OS/c18-15-3-5-16(6-4-15)20-11-9-19(10-12-20)7-1-2-8-21-14-23-13-17(21)22/h3-6H,1-2,7-14H2
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n/an/a 8.76E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053702
PNG
(3-(4-{4-[1-(4-Fluoro-phenyl)-1H-indol-3-yl]-pipera...)
Show SMILES Fc1ccc(cc1)-n1cc(N2CCN(CCCCN3CSC4(CCCCC4)C3=O)CC2)c2ccccc12
Show InChI InChI=1S/C30H37FN4OS/c31-24-10-12-25(13-11-24)35-22-28(26-8-2-3-9-27(26)35)33-20-18-32(19-21-33)16-6-7-17-34-23-37-30(29(34)36)14-4-1-5-15-30/h2-3,8-13,22H,1,4-7,14-21,23H2
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n/an/a 9.03E+3n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053698
PNG
(2-Methyl-3-{4-[4-(1-phenyl-1H-indol-3-yl)-piperazi...)
Show SMILES CC1SC2(CCCC2)C(=O)N1CCCCN1CCN(CC1)c1cn(-c2ccccc2)c2ccccc12
Show InChI InChI=1S/C30H38N4OS/c1-24-33(29(35)30(36-24)15-7-8-16-30)18-10-9-17-31-19-21-32(22-20-31)28-23-34(25-11-3-2-4-12-25)27-14-6-5-13-26(27)28/h2-6,11-14,23-24H,7-10,15-22H2,1H3
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n/an/a 1.17E+4n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards serotonin 5-HT1A receptor was determined in rat hippocampus using [3H]8-OH-DPAT as ligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053729
PNG
(3-[4-(4-m-Tolyl-piperazin-1-yl)-butyl]-thiazolidin...)
Show SMILES Cc1cccc(c1)N1CCN(CCCCN2CSCC2=O)CC1
Show InChI InChI=1S/C18H27N3OS/c1-16-5-4-6-17(13-16)20-11-9-19(10-12-20)7-2-3-8-21-15-23-14-18(21)22/h4-6,13H,2-3,7-12,14-15H2,1H3
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n/an/a 1.26E+4n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053717
PNG
(3-{4-[4-(4-Fluoro-phenyl)-piperazin-1-yl]-butyl}-t...)
Show SMILES Fc1ccc(cc1)N1CCN(CCCCN2CSCC2=O)CC1
Show InChI InChI=1S/C17H24FN3OS/c18-15-3-5-16(6-4-15)20-11-9-19(10-12-20)7-1-2-8-21-14-23-13-17(21)22/h3-6H,1-2,7-14H2
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n/an/a 1.29E+4n/an/an/an/an/an/a



Hoechst Marion Roussel, Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine receptor D2 was determined in rat striatum using [3H]- spiperone as radioligand


J Med Chem 39: 4044-57 (1996)


Article DOI: 10.1021/jm960268u
BindingDB Entry DOI: 10.7270/Q2ST7QH3
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%