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PubMed code 8809161

Compile data set for download or QSAR
Found 90 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
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50001786
PNG
(1-(2-{4-[5-chloro-1-(4-fluorophenyl)-1H-indol-3-yl...)
Show SMILES Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(Cl)ccc12
Show InChI InChI=1S/C24H26ClFN4O/c25-18-1-6-23-21(15-18)22(16-30(23)20-4-2-19(26)3-5-20)17-7-10-28(11-8-17)13-14-29-12-9-27-24(29)31/h1-6,15-17H,7-14H2,(H,27,31)
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n/an/a 0.390n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50001775
PNG
((ritanserin)6-(2-{4-[Bis-(4-fluoro-phenyl)-methyle...)
Show SMILES Cc1nc2sccn2c(=O)c1CCN1CCC(CC1)=C(c1ccc(F)cc1)c1ccc(F)cc1
Show InChI InChI=1S/C27H25F2N3OS/c1-18-24(26(33)32-16-17-34-27(32)30-18)12-15-31-13-10-21(11-14-31)25(19-2-6-22(28)7-3-19)20-4-8-23(29)9-5-20/h2-9,16-17H,10-15H2,1H3
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n/an/a 0.400n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50454212
PNG
(CHEBI:64217 | Emonapride | NEMONAPRIDE | Nemonapri...)
Show SMILES CNc1cc(OC)c(cc1Cl)C(=O)NC1CCN(Cc2ccccc2)C1C
Show InChI InChI=1S/C21H26ClN3O2/c1-14-18(9-10-25(14)13-15-7-5-4-6-8-15)24-21(26)16-11-17(22)19(23-2)12-20(16)27-3/h4-8,11-12,14,18,23H,9-10,13H2,1-3H3,(H,24,26)
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n/an/a 0.480n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053193
PNG
(1-[2-({2-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCOc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12)CCN1CCNC1=O
Show InChI InChI=1S/C22H24ClFN4O2/c1-26(10-11-27-9-8-25-22(27)29)12-13-30-21-15-28(18-5-3-17(24)4-6-18)20-7-2-16(23)14-19(20)21/h2-7,14-15H,8-13H2,1H3,(H,25,29)
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n/an/a 0.880n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053200
PNG
(1-[2-({2-[6-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCN1CCNC1=O)CCc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12
Show InChI InChI=1S/C22H24ClFN4O/c1-26(12-13-27-11-9-25-22(27)29)10-8-16-15-28(19-5-3-18(24)4-6-19)21-14-17(23)2-7-20(16)21/h2-7,14-15H,8-13H2,1H3,(H,25,29)
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n/an/a 0.950n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053205
PNG
(1-[3-({2-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCCN1CCNC1=O)CCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C23H26ClFN4O/c1-27(11-2-12-28-14-10-26-23(28)30)13-9-17-16-29(20-6-4-19(25)5-7-20)22-8-3-18(24)15-21(17)22/h3-8,15-16H,2,9-14H2,1H3,(H,26,30)
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n/an/a 1n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50001782
PNG
((Lu 26-042)1-(2-{4-[6-Chloro-1-(4-fluoro-phenyl)-1...)
Show SMILES CC(C)N1CCN(CCN2CCC(CC2)c2cn(-c3ccc(F)cc3)c3cc(Cl)ccc23)C1=O
Show InChI InChI=1S/C27H32ClFN4O/c1-19(2)32-16-15-31(27(32)34)14-13-30-11-9-20(10-12-30)25-18-33(23-6-4-22(29)5-7-23)26-17-21(28)3-8-24(25)26/h3-8,17-20H,9-16H2,1-2H3
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n/an/a 1.5n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053195
PNG
(1-[3-({2-[6-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCCN1CCNC1=O)CCc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12
Show InChI InChI=1S/C23H26ClFN4O/c1-27(11-2-12-28-14-10-26-23(28)30)13-9-17-16-29(20-6-4-19(25)5-7-20)22-15-18(24)3-8-21(17)22/h3-8,15-16H,2,9-14H2,1H3,(H,26,30)
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n/an/a 1.90n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053190
PNG
(1-[2-({2-[6-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCOc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12)CCN1CCNC1=O
Show InChI InChI=1S/C22H24ClFN4O2/c1-26(10-11-27-9-8-25-22(27)29)12-13-30-21-15-28(18-5-3-17(24)4-6-18)20-14-16(23)2-7-19(20)21/h2-7,14-15H,8-13H2,1H3,(H,25,29)
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n/an/a 2n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053198
PNG
(5-Chloro-1-(4-fluoro-phenyl)-3-(2-piperidin-1-yl-e...)
Show SMILES Fc1ccc(cc1)-n1cc(OCCN2CCCCC2)c2cc(Cl)ccc12
Show InChI InChI=1S/C21H22ClFN2O/c22-16-4-9-20-19(14-16)21(26-13-12-24-10-2-1-3-11-24)15-25(20)18-7-5-17(23)6-8-18/h4-9,14-15H,1-3,10-13H2
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n/an/a 2.30n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053192
PNG
(5-Chloro-1-(4-fluoro-phenyl)-3-[2-(4-methyl-pipera...)
Show SMILES CN1CCN(CCOc2cn(-c3ccc(F)cc3)c3ccc(Cl)cc23)CC1
Show InChI InChI=1S/C21H23ClFN3O/c1-24-8-10-25(11-9-24)12-13-27-21-15-26(18-5-3-17(23)4-6-18)20-7-2-16(22)14-19(20)21/h2-7,14-15H,8-13H2,1H3
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n/an/a 2.40n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053209
PNG
(CHEMBL125483 | {2-[5-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCOc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C18H18ClFN2O/c1-21(2)9-10-23-18-12-22(15-6-4-14(20)5-7-15)17-8-3-13(19)11-16(17)18/h3-8,11-12H,9-10H2,1-2H3
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n/an/a 2.90n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50001786
PNG
(1-(2-{4-[5-chloro-1-(4-fluorophenyl)-1H-indol-3-yl...)
Show SMILES Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(Cl)ccc12
Show InChI InChI=1S/C24H26ClFN4O/c25-18-1-6-23-21(15-18)22(16-30(23)20-4-2-19(26)3-5-20)17-7-10-28(11-8-17)13-14-29-12-9-27-24(29)31/h1-6,15-17H,7-14H2,(H,27,31)
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n/an/a 3.40n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50001786
PNG
(1-(2-{4-[5-chloro-1-(4-fluorophenyl)-1H-indol-3-yl...)
Show SMILES Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(Cl)ccc12
Show InChI InChI=1S/C24H26ClFN4O/c25-18-1-6-23-21(15-18)22(16-30(23)20-4-2-19(26)3-5-20)17-7-10-28(11-8-17)13-14-29-12-9-27-24(29)31/h1-6,15-17H,7-14H2,(H,27,31)
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n/an/a 4.10n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053209
PNG
(CHEMBL125483 | {2-[5-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCOc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C18H18ClFN2O/c1-21(2)9-10-23-18-12-22(15-6-4-14(20)5-7-15)17-8-3-13(19)11-16(17)18/h3-8,11-12H,9-10H2,1-2H3
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n/an/a 4.20n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053213
PNG
(1-[2-({2-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCN1CCNC1=O)CCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C22H24ClFN4O/c1-26(12-13-27-11-9-25-22(27)29)10-8-16-15-28(19-5-3-18(24)4-6-19)21-7-2-17(23)14-20(16)21/h2-7,14-15H,8-13H2,1H3,(H,25,29)
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n/an/a 5.30n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053211
PNG
(CHEMBL123640 | {2-[6-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12
Show InChI InChI=1S/C18H18ClFN2/c1-21(2)10-9-13-12-22(16-6-4-15(20)5-7-16)18-11-14(19)3-8-17(13)18/h3-8,11-12H,9-10H2,1-2H3
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n/an/a 5.5n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053193
PNG
(1-[2-({2-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCOc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12)CCN1CCNC1=O
Show InChI InChI=1S/C22H24ClFN4O2/c1-26(10-11-27-9-8-25-22(27)29)12-13-30-21-15-28(18-5-3-17(24)4-6-18)20-7-2-16(23)14-19(20)21/h2-7,14-15H,8-13H2,1H3,(H,25,29)
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n/an/a 5.70n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053193
PNG
(1-[2-({2-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCOc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12)CCN1CCNC1=O
Show InChI InChI=1S/C22H24ClFN4O2/c1-26(10-11-27-9-8-25-22(27)29)12-13-30-21-15-28(18-5-3-17(24)4-6-18)20-7-2-16(23)14-19(20)21/h2-7,14-15H,8-13H2,1H3,(H,25,29)
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n/an/a 5.80n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053208
PNG
(1-[2-({2-[6-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CC(C)N1CCN(CCN(C)CCc2cn(-c3ccc(F)cc3)c3cc(Cl)ccc23)C1=O
Show InChI InChI=1S/C25H30ClFN4O/c1-18(2)30-15-14-29(25(30)32)13-12-28(3)11-10-19-17-31(22-7-5-21(27)6-8-22)24-16-20(26)4-9-23(19)24/h4-9,16-18H,10-15H2,1-3H3
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n/an/a 5.80n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053198
PNG
(5-Chloro-1-(4-fluoro-phenyl)-3-(2-piperidin-1-yl-e...)
Show SMILES Fc1ccc(cc1)-n1cc(OCCN2CCCCC2)c2cc(Cl)ccc12
Show InChI InChI=1S/C21H22ClFN2O/c22-16-4-9-20-19(14-16)21(26-13-12-24-10-2-1-3-11-24)15-25(20)18-7-5-17(23)6-8-18/h4-9,14-15H,1-3,10-13H2
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n/an/a 5.90n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053206
PNG
(1-[2-({2-[6-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CC(C)N1CCN(CCN(C)CCOc2cn(-c3ccc(F)cc3)c3cc(Cl)ccc23)C1=O
Show InChI InChI=1S/C25H30ClFN4O2/c1-18(2)30-13-12-29(25(30)32)11-10-28(3)14-15-33-24-17-31(21-7-5-20(27)6-8-21)23-16-19(26)4-9-22(23)24/h4-9,16-18H,10-15H2,1-3H3
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n/an/a 6.30n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053212
PNG
(1-[2-({3-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12)CCN1CCNC1=O
Show InChI InChI=1S/C23H26ClFN4O/c1-27(13-14-28-12-10-26-23(28)30)11-2-3-17-16-29(20-7-5-19(25)6-8-20)22-9-4-18(24)15-21(17)22/h4-9,15-16H,2-3,10-14H2,1H3,(H,26,30)
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n/an/a 7.80n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053204
PNG
(CHEMBL332365 | {2-[5-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C18H18ClFN2/c1-21(2)10-9-13-12-22(16-6-4-15(20)5-7-16)18-8-3-14(19)11-17(13)18/h3-8,11-12H,9-10H2,1-2H3
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n/an/a 8.90n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053201
PNG
(1-[2-({2-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CCN(CCOc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12)CCN1CCNC1=O
Show InChI InChI=1S/C23H26ClFN4O2/c1-2-27(11-12-28-10-9-26-23(28)30)13-14-31-22-16-29(19-6-4-18(25)5-7-19)21-8-3-17(24)15-20(21)22/h3-8,15-16H,2,9-14H2,1H3,(H,26,30)
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n/an/a 12n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053194
PNG
(CHEMBL301956 | [5-Chloro-1-(4-fluoro-phenyl)-1H-in...)
Show SMILES CN(C)Cc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C17H16ClFN2/c1-20(2)10-12-11-21(15-6-4-14(19)5-7-15)17-8-3-13(18)9-16(12)17/h3-9,11H,10H2,1-2H3
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n/an/a 12n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50001775
PNG
((ritanserin)6-(2-{4-[Bis-(4-fluoro-phenyl)-methyle...)
Show SMILES Cc1nc2sccn2c(=O)c1CCN1CCC(CC1)=C(c1ccc(F)cc1)c1ccc(F)cc1
Show InChI InChI=1S/C27H25F2N3OS/c1-18-24(26(33)32-16-17-34-27(32)30-18)12-15-31-13-10-21(11-14-31)25(19-2-6-22(28)7-3-19)20-4-8-23(29)9-5-20/h2-9,16-17H,10-15H2,1H3
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n/an/a 12n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053205
PNG
(1-[3-({2-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCCN1CCNC1=O)CCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C23H26ClFN4O/c1-27(11-2-12-28-14-10-26-23(28)30)13-9-17-16-29(20-6-4-19(25)5-7-20)22-8-3-18(24)15-21(17)22/h3-8,15-16H,2,9-14H2,1H3,(H,26,30)
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n/an/a 14n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053200
PNG
(1-[2-({2-[6-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCN1CCNC1=O)CCc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12
Show InChI InChI=1S/C22H24ClFN4O/c1-26(12-13-27-11-9-25-22(27)29)10-8-16-15-28(19-5-3-18(24)4-6-19)21-14-17(23)2-7-20(16)21/h2-7,14-15H,8-13H2,1H3,(H,25,29)
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n/an/a 14n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053213
PNG
(1-[2-({2-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCN1CCNC1=O)CCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C22H24ClFN4O/c1-26(12-13-27-11-9-25-22(27)29)10-8-16-15-28(19-5-3-18(24)4-6-19)21-7-2-17(23)14-20(16)21/h2-7,14-15H,8-13H2,1H3,(H,25,29)
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n/an/a 15n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053209
PNG
(CHEMBL125483 | {2-[5-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCOc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C18H18ClFN2O/c1-21(2)9-10-23-18-12-22(15-6-4-14(20)5-7-15)17-8-3-13(19)11-16(17)18/h3-8,11-12H,9-10H2,1-2H3
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n/an/a 17n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053207
PNG
(CHEMBL339919 | {2-[6-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCOc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12
Show InChI InChI=1S/C18H18ClFN2O/c1-21(2)9-10-23-18-12-22(15-6-4-14(20)5-7-15)17-11-13(19)3-8-16(17)18/h3-8,11-12H,9-10H2,1-2H3
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n/an/a 17n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053201
PNG
(1-[2-({2-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CCN(CCOc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12)CCN1CCNC1=O
Show InChI InChI=1S/C23H26ClFN4O2/c1-2-27(11-12-28-10-9-26-23(28)30)13-14-31-22-16-29(19-6-4-18(25)5-7-19)21-8-3-17(24)15-20(21)22/h3-8,15-16H,2,9-14H2,1H3,(H,26,30)
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n/an/a 18n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053194
PNG
(CHEMBL301956 | [5-Chloro-1-(4-fluoro-phenyl)-1H-in...)
Show SMILES CN(C)Cc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C17H16ClFN2/c1-20(2)10-12-11-21(15-6-4-14(19)5-7-15)17-8-3-13(18)9-16(12)17/h3-9,11H,10H2,1-2H3
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n/an/a 18n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053201
PNG
(1-[2-({2-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CCN(CCOc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12)CCN1CCNC1=O
Show InChI InChI=1S/C23H26ClFN4O2/c1-2-27(11-12-28-10-9-26-23(28)30)13-14-31-22-16-29(19-6-4-18(25)5-7-19)21-8-3-17(24)15-20(21)22/h3-8,15-16H,2,9-14H2,1H3,(H,26,30)
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n/an/a 18n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053205
PNG
(1-[3-({2-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCCN1CCNC1=O)CCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C23H26ClFN4O/c1-27(11-2-12-28-14-10-26-23(28)30)13-9-17-16-29(20-6-4-19(25)5-7-20)22-8-3-18(24)15-21(17)22/h3-8,15-16H,2,9-14H2,1H3,(H,26,30)
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n/an/a 19n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053210
PNG
(CHEMBL123094 | {3-[5-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C19H20ClFN2/c1-22(2)11-3-4-14-13-23(17-8-6-16(21)7-9-17)19-10-5-15(20)12-18(14)19/h5-10,12-13H,3-4,11H2,1-2H3
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n/an/a 19n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053194
PNG
(CHEMBL301956 | [5-Chloro-1-(4-fluoro-phenyl)-1H-in...)
Show SMILES CN(C)Cc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C17H16ClFN2/c1-20(2)10-12-11-21(15-6-4-14(19)5-7-15)17-8-3-13(18)9-16(12)17/h3-9,11H,10H2,1-2H3
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n/an/a 19n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053188
PNG
(1-(2-{[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-ylm...)
Show SMILES CN(CCN1CCNC1=O)Cc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C21H22ClFN4O/c1-25(10-11-26-9-8-24-21(26)28)13-15-14-27(18-5-3-17(23)4-6-18)20-7-2-16(22)12-19(15)20/h2-7,12,14H,8-11,13H2,1H3,(H,24,28)
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n/an/a 20n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053202
PNG
(1-(4-{[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-ylm...)
Show SMILES CN(CCCCN1CCNC1=O)Cc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C23H26ClFN4O/c1-27(11-2-3-12-28-13-10-26-23(28)30)15-17-16-29(20-7-5-19(25)6-8-20)22-9-4-18(24)14-21(17)22/h4-9,14,16H,2-3,10-13,15H2,1H3,(H,26,30)
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n/an/a 20n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053188
PNG
(1-(2-{[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-ylm...)
Show SMILES CN(CCN1CCNC1=O)Cc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C21H22ClFN4O/c1-25(10-11-26-9-8-24-21(26)28)13-15-14-27(18-5-3-17(23)4-6-18)20-7-2-16(22)12-19(15)20/h2-7,12,14H,8-11,13H2,1H3,(H,24,28)
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n/an/a 22n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053188
PNG
(1-(2-{[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-ylm...)
Show SMILES CN(CCN1CCNC1=O)Cc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C21H22ClFN4O/c1-25(10-11-26-9-8-24-21(26)28)13-15-14-27(18-5-3-17(23)4-6-18)20-7-2-16(22)12-19(15)20/h2-7,12,14H,8-11,13H2,1H3,(H,24,28)
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n/an/a 23n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053196
PNG
(CHEMBL332077 | {3-[5-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCCOc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C19H20ClFN2O/c1-22(2)10-3-11-24-19-13-23(16-7-5-15(21)6-8-16)18-9-4-14(20)12-17(18)19/h4-9,12-13H,3,10-11H2,1-2H3
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n/an/a 24n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053213
PNG
(1-[2-({2-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCN1CCNC1=O)CCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C22H24ClFN4O/c1-26(12-13-27-11-9-25-22(27)29)10-8-16-15-28(19-5-3-18(24)4-6-19)21-7-2-17(23)14-20(16)21/h2-7,14-15H,8-13H2,1H3,(H,25,29)
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n/an/a 25n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053196
PNG
(CHEMBL332077 | {3-[5-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCCOc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C19H20ClFN2O/c1-22(2)10-3-11-24-19-13-23(16-7-5-15(21)6-8-16)18-9-4-14(20)12-17(18)19/h4-9,12-13H,3,10-11H2,1-2H3
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n/an/a 27n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053197
PNG
(5-Chloro-1-(4-fluoro-phenyl)-3-(2-morpholin-4-yl-e...)
Show SMILES Fc1ccc(cc1)-n1cc(OCCN2CCOCC2)c2cc(Cl)ccc12
Show InChI InChI=1S/C20H20ClFN2O2/c21-15-1-6-19-18(13-15)20(26-12-9-23-7-10-25-11-8-23)14-24(19)17-4-2-16(22)3-5-17/h1-6,13-14H,7-12H2
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n/an/a 27n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053198
PNG
(5-Chloro-1-(4-fluoro-phenyl)-3-(2-piperidin-1-yl-e...)
Show SMILES Fc1ccc(cc1)-n1cc(OCCN2CCCCC2)c2cc(Cl)ccc12
Show InChI InChI=1S/C21H22ClFN2O/c22-16-4-9-20-19(14-16)21(26-13-12-24-10-2-1-3-11-24)15-25(20)18-7-5-17(23)6-8-18/h4-9,14-15H,1-3,10-13H2
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n/an/a 32n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053204
PNG
(CHEMBL332365 | {2-[5-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C18H18ClFN2/c1-21(2)10-9-13-12-22(16-6-4-15(20)5-7-16)18-8-3-14(19)11-17(13)18/h3-8,11-12H,9-10H2,1-2H3
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n/an/a 38n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053204
PNG
(CHEMBL332365 | {2-[5-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C18H18ClFN2/c1-21(2)10-9-13-12-22(16-6-4-15(20)5-7-16)18-8-3-14(19)11-17(13)18/h3-8,11-12H,9-10H2,1-2H3
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n/an/a 40n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053190
PNG
(1-[2-({2-[6-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCOc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12)CCN1CCNC1=O
Show InChI InChI=1S/C22H24ClFN4O2/c1-26(10-11-27-9-8-25-22(27)29)12-13-30-21-15-28(18-5-3-17(24)4-6-18)20-14-16(23)2-7-19(20)21/h2-7,14-15H,8-13H2,1H3,(H,25,29)
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n/an/a 41n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053203
PNG
(CHEMBL123027 | {2-[5-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCSc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C18H18ClFN2S/c1-21(2)9-10-23-18-12-22(15-6-4-14(20)5-7-15)17-8-3-13(19)11-16(17)18/h3-8,11-12H,9-10H2,1-2H3
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n/an/a 42n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053210
PNG
(CHEMBL123094 | {3-[5-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C19H20ClFN2/c1-22(2)11-3-4-14-13-23(17-8-6-16(21)7-9-17)19-10-5-15(20)12-18(14)19/h5-10,12-13H,3-4,11H2,1-2H3
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n/an/a 42n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053212
PNG
(1-[2-({3-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12)CCN1CCNC1=O
Show InChI InChI=1S/C23H26ClFN4O/c1-27(13-14-28-12-10-26-23(28)30)11-2-3-17-16-29(20-7-5-19(25)6-8-20)22-9-4-18(24)15-21(17)22/h4-9,15-16H,2-3,10-14H2,1H3,(H,26,30)
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n/an/a 43n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50001775
PNG
((ritanserin)6-(2-{4-[Bis-(4-fluoro-phenyl)-methyle...)
Show SMILES Cc1nc2sccn2c(=O)c1CCN1CCC(CC1)=C(c1ccc(F)cc1)c1ccc(F)cc1
Show InChI InChI=1S/C27H25F2N3OS/c1-18-24(26(33)32-16-17-34-27(32)30-18)12-15-31-13-10-21(11-14-31)25(19-2-6-22(28)7-3-19)20-4-8-23(29)9-5-20/h2-9,16-17H,10-15H2,1H3
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n/an/a 47n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053197
PNG
(5-Chloro-1-(4-fluoro-phenyl)-3-(2-morpholin-4-yl-e...)
Show SMILES Fc1ccc(cc1)-n1cc(OCCN2CCOCC2)c2cc(Cl)ccc12
Show InChI InChI=1S/C20H20ClFN2O2/c21-15-1-6-19-18(13-15)20(26-12-9-23-7-10-25-11-8-23)14-24(19)17-4-2-16(22)3-5-17/h1-6,13-14H,7-12H2
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n/an/a 48n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50454212
PNG
(CHEBI:64217 | Emonapride | NEMONAPRIDE | Nemonapri...)
Show SMILES CNc1cc(OC)c(cc1Cl)C(=O)NC1CCN(Cc2ccccc2)C1C
Show InChI InChI=1S/C21H26ClN3O2/c1-14-18(9-10-25(14)13-15-7-5-4-6-8-15)24-21(26)16-11-17(22)19(23-2)12-20(16)27-3/h4-8,11-12,14,18,23H,9-10,13H2,1-3H3,(H,24,26)
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n/an/a 49n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053195
PNG
(1-[3-({2-[6-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCCN1CCNC1=O)CCc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12
Show InChI InChI=1S/C23H26ClFN4O/c1-27(11-2-12-28-14-10-26-23(28)30)13-9-17-16-29(20-6-4-19(25)5-7-20)22-15-18(24)3-8-21(17)22/h3-8,15-16H,2,9-14H2,1H3,(H,26,30)
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n/an/a 54n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053207
PNG
(CHEMBL339919 | {2-[6-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCOc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12
Show InChI InChI=1S/C18H18ClFN2O/c1-21(2)9-10-23-18-12-22(15-6-4-14(20)5-7-15)17-11-13(19)3-8-16(17)18/h3-8,11-12H,9-10H2,1-2H3
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n/an/a 63n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50001782
PNG
((Lu 26-042)1-(2-{4-[6-Chloro-1-(4-fluoro-phenyl)-1...)
Show SMILES CC(C)N1CCN(CCN2CCC(CC2)c2cn(-c3ccc(F)cc3)c3cc(Cl)ccc23)C1=O
Show InChI InChI=1S/C27H32ClFN4O/c1-19(2)32-16-15-31(27(32)34)14-13-30-11-9-20(10-12-30)25-18-33(23-6-4-22(29)5-7-23)26-17-21(28)3-8-24(25)26/h3-8,17-20H,9-16H2,1-2H3
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n/an/a 70n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053210
PNG
(CHEMBL123094 | {3-[5-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C19H20ClFN2/c1-22(2)11-3-4-14-13-23(17-8-6-16(21)7-9-17)19-10-5-15(20)12-18(14)19/h5-10,12-13H,3-4,11H2,1-2H3
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n/an/a 73n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053199
PNG
(1-[2-({2-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCSc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12)CCN1CCNC1=O
Show InChI InChI=1S/C22H24ClFN4OS/c1-26(10-11-27-9-8-25-22(27)29)12-13-30-21-15-28(18-5-3-17(24)4-6-18)20-7-2-16(23)14-19(20)21/h2-7,14-15H,8-13H2,1H3,(H,25,29)
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n/an/a 86n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053191
PNG
(1-[2-({2-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES Fc1ccc(cc1)-n1cc(OCCN(CCN2CCNC2=O)CC#C)c2cc(Cl)ccc12
Show InChI InChI=1S/C24H24ClFN4O2/c1-2-10-28(12-13-29-11-9-27-24(29)31)14-15-32-23-17-30(20-6-4-19(26)5-7-20)22-8-3-18(25)16-21(22)23/h1,3-8,16-17H,9-15H2,(H,27,31)
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n/an/a 88n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053196
PNG
(CHEMBL332077 | {3-[5-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCCOc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C19H20ClFN2O/c1-22(2)10-3-11-24-19-13-23(16-7-5-15(21)6-8-16)18-9-4-14(20)12-17(18)19/h4-9,12-13H,3,10-11H2,1-2H3
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n/an/a>100n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053192
PNG
(5-Chloro-1-(4-fluoro-phenyl)-3-[2-(4-methyl-pipera...)
Show SMILES CN1CCN(CCOc2cn(-c3ccc(F)cc3)c3ccc(Cl)cc23)CC1
Show InChI InChI=1S/C21H23ClFN3O/c1-24-8-10-25(11-9-24)12-13-27-21-15-26(18-5-3-17(23)4-6-18)20-7-2-16(22)14-19(20)21/h2-7,14-15H,8-13H2,1H3
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n/an/a 100n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053189
PNG
(CHEMBL122384 | {4-[5-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCCCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C20H22ClFN2/c1-23(2)12-4-3-5-15-14-24(18-9-7-17(22)8-10-18)20-11-6-16(21)13-19(15)20/h6-11,13-14H,3-5,12H2,1-2H3
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n/an/a 100n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053202
PNG
(1-(4-{[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-ylm...)
Show SMILES CN(CCCCN1CCNC1=O)Cc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C23H26ClFN4O/c1-27(11-2-3-12-28-13-10-26-23(28)30)15-17-16-29(20-7-5-19(25)6-8-20)22-9-4-18(24)14-21(17)22/h4-9,14,16H,2-3,10-13,15H2,1H3,(H,26,30)
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n/an/a>100n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053197
PNG
(5-Chloro-1-(4-fluoro-phenyl)-3-(2-morpholin-4-yl-e...)
Show SMILES Fc1ccc(cc1)-n1cc(OCCN2CCOCC2)c2cc(Cl)ccc12
Show InChI InChI=1S/C20H20ClFN2O2/c21-15-1-6-19-18(13-15)20(26-12-9-23-7-10-25-11-8-23)14-24(19)17-4-2-16(22)3-5-17/h1-6,13-14H,7-12H2
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n/an/a 110n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053202
PNG
(1-(4-{[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-ylm...)
Show SMILES CN(CCCCN1CCNC1=O)Cc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C23H26ClFN4O/c1-27(11-2-3-12-28-13-10-26-23(28)30)15-17-16-29(20-7-5-19(25)6-8-20)22-9-4-18(24)14-21(17)22/h4-9,14,16H,2-3,10-13,15H2,1H3,(H,26,30)
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n/an/a 110n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053206
PNG
(1-[2-({2-[6-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CC(C)N1CCN(CCN(C)CCOc2cn(-c3ccc(F)cc3)c3cc(Cl)ccc23)C1=O
Show InChI InChI=1S/C25H30ClFN4O2/c1-18(2)30-13-12-29(25(30)32)11-10-28(3)14-15-33-24-17-31(21-7-5-20(27)6-8-21)23-16-19(26)4-9-22(23)24/h4-9,16-18H,10-15H2,1-3H3
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n/an/a 120n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053211
PNG
(CHEMBL123640 | {2-[6-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12
Show InChI InChI=1S/C18H18ClFN2/c1-21(2)10-9-13-12-22(16-6-4-15(20)5-7-16)18-11-14(19)3-8-17(13)18/h3-8,11-12H,9-10H2,1-2H3
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n/an/a 130n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50001782
PNG
((Lu 26-042)1-(2-{4-[6-Chloro-1-(4-fluoro-phenyl)-1...)
Show SMILES CC(C)N1CCN(CCN2CCC(CC2)c2cn(-c3ccc(F)cc3)c3cc(Cl)ccc23)C1=O
Show InChI InChI=1S/C27H32ClFN4O/c1-19(2)32-16-15-31(27(32)34)14-13-30-11-9-20(10-12-30)25-18-33(23-6-4-22(29)5-7-23)26-17-21(28)3-8-24(25)26/h3-8,17-20H,9-16H2,1-2H3
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n/an/a 130n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053203
PNG
(CHEMBL123027 | {2-[5-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCSc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C18H18ClFN2S/c1-21(2)9-10-23-18-12-22(15-6-4-14(20)5-7-15)17-8-3-13(19)11-16(17)18/h3-8,11-12H,9-10H2,1-2H3
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n/an/a 140n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053192
PNG
(5-Chloro-1-(4-fluoro-phenyl)-3-[2-(4-methyl-pipera...)
Show SMILES CN1CCN(CCOc2cn(-c3ccc(F)cc3)c3ccc(Cl)cc23)CC1
Show InChI InChI=1S/C21H23ClFN3O/c1-24-8-10-25(11-9-24)12-13-27-21-15-26(18-5-3-17(23)4-6-18)20-7-2-16(22)14-19(20)21/h2-7,14-15H,8-13H2,1H3
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n/an/a 150n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053207
PNG
(CHEMBL339919 | {2-[6-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCOc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12
Show InChI InChI=1S/C18H18ClFN2O/c1-21(2)9-10-23-18-12-22(15-6-4-14(20)5-7-15)17-11-13(19)3-8-16(17)18/h3-8,11-12H,9-10H2,1-2H3
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n/an/a 170n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053191
PNG
(1-[2-({2-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES Fc1ccc(cc1)-n1cc(OCCN(CCN2CCNC2=O)CC#C)c2cc(Cl)ccc12
Show InChI InChI=1S/C24H24ClFN4O2/c1-2-10-28(12-13-29-11-9-27-24(29)31)14-15-32-23-17-30(20-6-4-19(26)5-7-20)22-8-3-18(25)16-21(22)23/h1,3-8,16-17H,9-15H2,(H,27,31)
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n/an/a 190n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053208
PNG
(1-[2-({2-[6-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CC(C)N1CCN(CCN(C)CCc2cn(-c3ccc(F)cc3)c3cc(Cl)ccc23)C1=O
Show InChI InChI=1S/C25H30ClFN4O/c1-18(2)30-15-14-29(25(30)32)13-12-28(3)11-10-19-17-31(22-7-5-21(27)6-8-22)24-16-20(26)4-9-23(19)24/h4-9,16-18H,10-15H2,1-3H3
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n/an/a 190n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053212
PNG
(1-[2-({3-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12)CCN1CCNC1=O
Show InChI InChI=1S/C23H26ClFN4O/c1-27(13-14-28-12-10-26-23(28)30)11-2-3-17-16-29(20-7-5-19(25)6-8-20)22-9-4-18(24)15-21(17)22/h4-9,15-16H,2-3,10-14H2,1H3,(H,26,30)
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n/an/a 190n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053190
PNG
(1-[2-({2-[6-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCOc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12)CCN1CCNC1=O
Show InChI InChI=1S/C22H24ClFN4O2/c1-26(10-11-27-9-8-25-22(27)29)12-13-30-21-15-28(18-5-3-17(24)4-6-18)20-14-16(23)2-7-19(20)21/h2-7,14-15H,8-13H2,1H3,(H,25,29)
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n/an/a 200n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50053191
PNG
(1-[2-({2-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES Fc1ccc(cc1)-n1cc(OCCN(CCN2CCNC2=O)CC#C)c2cc(Cl)ccc12
Show InChI InChI=1S/C24H24ClFN4O2/c1-2-10-28(12-13-29-11-9-27-24(29)31)14-15-32-23-17-30(20-6-4-19(26)5-7-20)22-8-3-18(25)16-21(22)23/h1,3-8,16-17H,9-15H2,(H,27,31)
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n/an/a 220n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to serotonin 5-hydroxytryptamine 2A receptors using a radioligand [3H]-ketanserin binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053189
PNG
(CHEMBL122384 | {4-[5-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCCCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C20H22ClFN2/c1-23(2)12-4-3-5-15-14-24(18-9-7-17(22)8-10-18)20-11-6-16(21)13-19(15)20/h6-11,13-14H,3-5,12H2,1-2H3
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n/an/a 310n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053195
PNG
(1-[3-({2-[6-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCCN1CCNC1=O)CCc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12
Show InChI InChI=1S/C23H26ClFN4O/c1-27(11-2-12-28-14-10-26-23(28)30)13-9-17-16-29(20-6-4-19(25)5-7-20)22-15-18(24)3-8-21(17)22/h3-8,15-16H,2,9-14H2,1H3,(H,26,30)
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n/an/a 400n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053208
PNG
(1-[2-({2-[6-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CC(C)N1CCN(CCN(C)CCc2cn(-c3ccc(F)cc3)c3cc(Cl)ccc23)C1=O
Show InChI InChI=1S/C25H30ClFN4O/c1-18(2)30-15-14-29(25(30)32)13-12-28(3)11-10-19-17-31(22-7-5-21(27)6-8-22)24-16-20(26)4-9-23(19)24/h4-9,16-18H,10-15H2,1-3H3
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n/an/a 400n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50454212
PNG
(CHEBI:64217 | Emonapride | NEMONAPRIDE | Nemonapri...)
Show SMILES CNc1cc(OC)c(cc1Cl)C(=O)NC1CCN(Cc2ccccc2)C1C
Show InChI InChI=1S/C21H26ClN3O2/c1-14-18(9-10-25(14)13-15-7-5-4-6-8-15)24-21(26)16-11-17(22)19(23-2)12-20(16)27-3/h4-8,11-12,14,18,23H,9-10,13H2,1-3H3,(H,24,26)
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n/an/a 540n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053200
PNG
(1-[2-({2-[6-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCN1CCNC1=O)CCc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12
Show InChI InChI=1S/C22H24ClFN4O/c1-26(12-13-27-11-9-25-22(27)29)10-8-16-15-28(19-5-3-18(24)4-6-19)21-14-17(23)2-7-20(16)21/h2-7,14-15H,8-13H2,1H3,(H,25,29)
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n/an/a 590n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053206
PNG
(1-[2-({2-[6-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CC(C)N1CCN(CCN(C)CCOc2cn(-c3ccc(F)cc3)c3cc(Cl)ccc23)C1=O
Show InChI InChI=1S/C25H30ClFN4O2/c1-18(2)30-13-12-29(25(30)32)11-10-28(3)14-15-33-24-17-31(21-7-5-20(27)6-8-21)23-16-19(26)4-9-22(23)24/h4-9,16-18H,10-15H2,1-3H3
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n/an/a 600n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053211
PNG
(CHEMBL123640 | {2-[6-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCc1cn(-c2ccc(F)cc2)c2cc(Cl)ccc12
Show InChI InChI=1S/C18H18ClFN2/c1-21(2)10-9-13-12-22(16-6-4-15(20)5-7-16)18-11-14(19)3-8-17(13)18/h3-8,11-12H,9-10H2,1-2H3
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n/an/a 650n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053199
PNG
(1-[2-({2-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCSc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12)CCN1CCNC1=O
Show InChI InChI=1S/C22H24ClFN4OS/c1-26(10-11-27-9-8-25-22(27)29)12-13-30-21-15-28(18-5-3-17(24)4-6-18)20-7-2-16(23)14-19(20)21/h2-7,14-15H,8-13H2,1H3,(H,25,29)
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n/an/a 650n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053199
PNG
(1-[2-({2-[5-Chloro-1-(4-fluoro-phenyl)-1H-indol-3-...)
Show SMILES CN(CCSc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12)CCN1CCNC1=O
Show InChI InChI=1S/C22H24ClFN4OS/c1-26(10-11-27-9-8-25-22(27)29)12-13-30-21-15-28(18-5-3-17(24)4-6-18)20-7-2-16(23)14-19(20)21/h2-7,14-15H,8-13H2,1H3,(H,25,29)
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n/an/a 790n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50053203
PNG
(CHEMBL123027 | {2-[5-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCSc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C18H18ClFN2S/c1-21(2)9-10-23-18-12-22(15-6-4-14(20)5-7-15)17-8-3-13(19)11-16(17)18/h3-8,11-12H,9-10H2,1-2H3
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n/an/a 820n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to the alpha-1 adrenergic receptor using a radioligand [3H]-prazosin binding assay in rat brain membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50053189
PNG
(CHEMBL122384 | {4-[5-Chloro-1-(4-fluoro-phenyl)-1H...)
Show SMILES CN(C)CCCCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12
Show InChI InChI=1S/C20H22ClFN2/c1-23(2)12-4-3-5-15-14-24(18-9-7-17(22)8-10-18)20-11-6-16(21)13-19(15)20/h6-11,13-14H,3-5,12H2,1-2H3
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n/an/a 4.80E+3n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity to dopamine receptor D2 using a [3H]-spiperone binding assay in rat cortical membranes


J Med Chem 39: 3723-38 (1996)


Article DOI: 10.1021/jm960159f
BindingDB Entry DOI: 10.7270/Q2CZ368W
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%