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5 similar compounds to monomer 50002338

Compile data set for download or QSAR
Wt: 402.5
BDBM86723
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Wt: 386.5
BDBM50131440
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Wt: 386.5
BDBM50370414
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 69 hits for monomerid = 86723,50131440,50370414   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM86723
PNG
(CAS_14759-06-9 | NSC_31765 | sulforidazine)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)(=O)=O
Show InChI InChI=1S/C21H26N2O2S2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)26-21-11-10-17(15-19(21)23)27(2,24)25/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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0.200n/an/an/an/an/an/an/an/a



ACADIA Pharmaceuticals

Curated by PDSP Ki Database




J Pharmacol Exp Ther 315: 1278-87 (2005)


Article DOI: 10.1124/jpet.105.092155
BindingDB Entry DOI: 10.7270/Q2Z60MNB
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM86723
PNG
(CAS_14759-06-9 | NSC_31765 | sulforidazine)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)(=O)=O
Show InChI InChI=1S/C21H26N2O2S2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)26-21-11-10-17(15-19(21)23)27(2,24)25/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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0.300n/an/an/an/an/an/an/an/a



ACADIA Pharmaceuticals

Curated by PDSP Ki Database




J Pharmacol Exp Ther 315: 1278-87 (2005)


Article DOI: 10.1124/jpet.105.092155
BindingDB Entry DOI: 10.7270/Q2Z60MNB
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM86723
PNG
(CAS_14759-06-9 | NSC_31765 | sulforidazine)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)(=O)=O
Show InChI InChI=1S/C21H26N2O2S2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)26-21-11-10-17(15-19(21)23)27(2,24)25/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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0.700n/an/an/an/an/an/an/an/a



ACADIA Pharmaceuticals

Curated by PDSP Ki Database




J Pharmacol Exp Ther 315: 1278-87 (2005)


Article DOI: 10.1124/jpet.105.092155
BindingDB Entry DOI: 10.7270/Q2Z60MNB
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50370414
PNG
(CHEMBL611207 | MESORIDAZINE)
Show SMILES CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3/t16-,26+/m1/s1
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1.20n/an/an/an/an/an/an/an/a



Brigham& Women's Hospital

Curated by ChEMBL


Assay Description
High binding affinity towards human D2 dopamine receptor was determined by using [3H]YM-09151-2 as radioligand


Bioorg Med Chem Lett 14: 4379-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.078
BindingDB Entry DOI: 10.7270/Q2NZ88DW
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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1.80n/an/an/an/an/an/an/an/a



Mayo Clinic and Foundation

Curated by PDSP Ki Database




Eur J Pharmacol 103: 197-204 (1984)


BindingDB Entry DOI: 10.7270/Q2WW7G5B
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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1.81n/an/an/an/an/an/an/an/a



Mayo Clinic and Foundation

Curated by PDSP Ki Database




Ann N Y Acad Sci 537: 435-42 (1988)


Article DOI: 10.1111/j.1749-6632.1988.tb42125.x
BindingDB Entry DOI: 10.7270/Q2X065JH
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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2n/an/an/an/an/an/an/an/a



Mayo Clinic and Foundation

Curated by PDSP Ki Database




Ann N Y Acad Sci 537: 435-42 (1988)


Article DOI: 10.1111/j.1749-6632.1988.tb42125.x
BindingDB Entry DOI: 10.7270/Q2X065JH
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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2n/an/an/an/an/an/an/an/a



Mayo Clinic and Foundation

Curated by PDSP Ki Database




Eur J Pharmacol 103: 197-204 (1984)


BindingDB Entry DOI: 10.7270/Q2WW7G5B
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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2.60n/an/an/an/an/an/an/an/a



ACADIA Pharmaceuticals

Curated by PDSP Ki Database




J Pharmacol Exp Ther 315: 1278-87 (2005)


Article DOI: 10.1124/jpet.105.092155
BindingDB Entry DOI: 10.7270/Q2Z60MNB
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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4.30n/an/an/an/an/an/an/an/a



ACADIA Pharmaceuticals

Curated by PDSP Ki Database




J Pharmacol Exp Ther 315: 1278-87 (2005)


Article DOI: 10.1124/jpet.105.092155
BindingDB Entry DOI: 10.7270/Q2Z60MNB
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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4.76n/an/an/an/an/an/an/an/a



Mayo Clinic and Foundation

Curated by PDSP Ki Database




Ann N Y Acad Sci 537: 435-42 (1988)


Article DOI: 10.1111/j.1749-6632.1988.tb42125.x
BindingDB Entry DOI: 10.7270/Q2X065JH
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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5n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




Psychopharmacology (Berl) 120: 365-8 (1995)


BindingDB Entry DOI: 10.7270/Q2VT1QKB
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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6.30n/an/an/an/an/an/an/an/a



Stanford University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 260: 1361-5 (1992)


BindingDB Entry DOI: 10.7270/Q2513WPC
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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6.30n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




Psychopharmacology (Berl) 120: 365-8 (1995)


BindingDB Entry DOI: 10.7270/Q2VT1QKB
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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6.30n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 268: 1403-10 (1994)


BindingDB Entry DOI: 10.7270/Q2154FJQ
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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7.94n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 268: 1403-10 (1994)


BindingDB Entry DOI: 10.7270/Q2154FJQ
More data for this
Ligand-Target Pair
Dopamine receptors; D2 & D4


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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9.10n/an/an/an/an/an/an/an/a



ACADIA Pharmaceuticals

Curated by PDSP Ki Database




J Pharmacol Exp Ther 315: 1278-87 (2005)


Article DOI: 10.1124/jpet.105.092155
BindingDB Entry DOI: 10.7270/Q2Z60MNB
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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10n/an/an/an/an/an/an/an/a



Mayo Clinic Jacksonville

Curated by PDSP Ki Database




J Pharmacol Exp Ther 260: 576-80 (1992)


BindingDB Entry DOI: 10.7270/Q28P5Z0G
More data for this
Ligand-Target Pair
Dopamine receptor


(RAT)
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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13.4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




Psychopharmacology (Berl) 120: 365-8 (1995)


BindingDB Entry DOI: 10.7270/Q2VT1QKB
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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15n/an/an/an/an/an/an/an/a



Mayo Clinic Jacksonville

Curated by PDSP Ki Database




J Pharmacol Exp Ther 260: 576-80 (1992)


BindingDB Entry DOI: 10.7270/Q28P5Z0G
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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18.9n/an/an/an/an/an/an/an/a



Mayo Clinic and Foundation

Curated by PDSP Ki Database




Ann N Y Acad Sci 537: 435-42 (1988)


Article DOI: 10.1111/j.1749-6632.1988.tb42125.x
BindingDB Entry DOI: 10.7270/Q2X065JH
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50370414
PNG
(CHEMBL611207 | MESORIDAZINE)
Show SMILES CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3/t16-,26+/m1/s1
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19n/an/an/an/an/an/an/an/a



Brigham& Women's Hospital

Curated by ChEMBL


Assay Description
Binding affinity towards rat 5-hydroxytryptamine 2A receptor was determined by using [3H]-ketanserin as radioligand


Bioorg Med Chem Lett 14: 4379-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.078
BindingDB Entry DOI: 10.7270/Q2NZ88DW
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50370414
PNG
(CHEMBL611207 | MESORIDAZINE)
Show SMILES CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3/t16-,26+/m1/s1
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19n/an/an/an/an/an/an/an/a



Brigham& Women's Hospital

Curated by ChEMBL


Assay Description
Binding affinity towards rat 5-hydroxytryptamine 2A receptor was determined by using [3H]-ketanserin as radioligand


Bioorg Med Chem Lett 14: 4379-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.078
BindingDB Entry DOI: 10.7270/Q2NZ88DW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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19n/an/an/an/an/an/an/an/a



Mayo Clinic Jacksonville

Curated by PDSP Ki Database




J Pharmacol Exp Ther 260: 576-80 (1992)


BindingDB Entry DOI: 10.7270/Q28P5Z0G
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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19n/an/an/an/an/an/an/an/a



Mayo Clinic and Foundation

Curated by PDSP Ki Database




Eur J Pharmacol 103: 197-204 (1984)


BindingDB Entry DOI: 10.7270/Q2WW7G5B
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50370414
PNG
(CHEMBL611207 | MESORIDAZINE)
Show SMILES CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3/t16-,26+/m1/s1
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23n/an/an/an/an/an/an/an/a



Brigham& Women's Hospital

Curated by ChEMBL


Assay Description
Binding affinity towards human D3 dopamine receptor was determined by using [3H]YM-09151-2 as radioligand


Bioorg Med Chem Lett 14: 4379-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.078
BindingDB Entry DOI: 10.7270/Q2NZ88DW
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50370414
PNG
(CHEMBL611207 | MESORIDAZINE)
Show SMILES CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3/t16-,26+/m1/s1
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23n/an/an/an/an/an/an/an/a



Brigham& Women's Hospital

Curated by ChEMBL


Assay Description
Binding affinity towards human D3 dopamine receptor was determined by using [3H]YM-09151-2 as radioligand


Bioorg Med Chem Lett 14: 4379-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.078
BindingDB Entry DOI: 10.7270/Q2NZ88DW
More data for this
Ligand-Target Pair
CHRM5


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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60n/an/an/an/an/an/an/an/a



Mayo Clinic Jacksonville

Curated by PDSP Ki Database




J Pharmacol Exp Ther 260: 576-80 (1992)


BindingDB Entry DOI: 10.7270/Q28P5Z0G
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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69n/an/an/an/an/an/an/an/a



Mayo Clinic and Foundation

Curated by PDSP Ki Database




Eur J Pharmacol 103: 197-204 (1984)


BindingDB Entry DOI: 10.7270/Q2WW7G5B
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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71.4n/an/an/an/an/an/an/an/a



Mayo Clinic and Foundation

Curated by PDSP Ki Database




Ann N Y Acad Sci 537: 435-42 (1988)


Article DOI: 10.1111/j.1749-6632.1988.tb42125.x
BindingDB Entry DOI: 10.7270/Q2X065JH
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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73n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 268: 1403-10 (1994)


BindingDB Entry DOI: 10.7270/Q2154FJQ
More data for this
Ligand-Target Pair
Serotonin receptor 2a and 2c (5HT2A and 5HT2C)


(Rattus norvegicus (Rat))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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79n/an/an/an/an/an/an/an/a



Stanford University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 260: 1361-5 (1992)


BindingDB Entry DOI: 10.7270/Q2513WPC
More data for this
Ligand-Target Pair
Serotonin receptor 2a and 2c (5HT2A and 5HT2C)


(Rattus norvegicus (Rat))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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79.4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 268: 1403-10 (1994)


BindingDB Entry DOI: 10.7270/Q2154FJQ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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90n/an/an/an/an/an/an/an/a



Mayo Clinic Jacksonville

Curated by PDSP Ki Database




J Pharmacol Exp Ther 260: 576-80 (1992)


BindingDB Entry DOI: 10.7270/Q28P5Z0G
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50370414
PNG
(CHEMBL611207 | MESORIDAZINE)
Show SMILES CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3/t16-,26+/m1/s1
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95n/an/an/an/an/an/an/an/a



Brigham& Women's Hospital

Curated by ChEMBL


Assay Description
Binding affinity towards human D3 dopamine receptor was determined by using [3H]YM-09151-2 as radioligand


Bioorg Med Chem Lett 14: 4379-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.078
BindingDB Entry DOI: 10.7270/Q2NZ88DW
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50370414
PNG
(CHEMBL611207 | MESORIDAZINE)
Show SMILES CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3/t16-,26+/m1/s1
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95n/an/an/an/an/an/an/an/a



Brigham& Women's Hospital

Curated by ChEMBL


Assay Description
Binding affinity towards human D3 dopamine receptor was determined by using [3H]YM-09151-2 as radioligand


Bioorg Med Chem Lett 14: 4379-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.078
BindingDB Entry DOI: 10.7270/Q2NZ88DW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50370414
PNG
(CHEMBL611207 | MESORIDAZINE)
Show SMILES CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3/t16-,26+/m1/s1
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105n/an/an/an/an/an/an/an/a



Brigham& Women's Hospital

Curated by ChEMBL


Assay Description
Binding affinity towards human 5-hydroxytryptamine 1A receptor was determined by using [3H]8-OH-DPAT as radioligand


Bioorg Med Chem Lett 14: 4379-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.078
BindingDB Entry DOI: 10.7270/Q2NZ88DW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50370414
PNG
(CHEMBL611207 | MESORIDAZINE)
Show SMILES CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3/t16-,26+/m1/s1
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105n/an/an/an/an/an/an/an/a



Brigham& Women's Hospital

Curated by ChEMBL


Assay Description
Binding affinity towards human 5-hydroxytryptamine 1A receptor was determined by using [3H]8-OH-DPAT as radioligand


Bioorg Med Chem Lett 14: 4379-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.078
BindingDB Entry DOI: 10.7270/Q2NZ88DW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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157n/an/an/an/an/an/an/an/a



Albany Medical College

Curated by PDSP Ki Database




J Pharmacol Exp Ther 295: 226-32 (2000)


BindingDB Entry DOI: 10.7270/Q29P3064
More data for this
Ligand-Target Pair
HTR6


(RAT)
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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159n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 268: 1403-10 (1994)


BindingDB Entry DOI: 10.7270/Q2154FJQ
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50370414
PNG
(CHEMBL611207 | MESORIDAZINE)
Show SMILES CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3/t16-,26+/m1/s1
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317n/an/an/an/an/an/an/an/a



Brigham& Women's Hospital

Curated by ChEMBL


Assay Description
Binding affinity towards human D1 dopamine receptor was determined by using [3H]-SCH- 23390 as radioligand


Bioorg Med Chem Lett 14: 4379-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.078
BindingDB Entry DOI: 10.7270/Q2NZ88DW
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50370414
PNG
(CHEMBL611207 | MESORIDAZINE)
Show SMILES CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3/t16-,26+/m1/s1
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317n/an/an/an/an/an/an/an/a



Brigham& Women's Hospital

Curated by ChEMBL


Assay Description
Binding affinity towards human D1 dopamine receptor was determined by using [3H]-SCH- 23390 as radioligand


Bioorg Med Chem Lett 14: 4379-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.078
BindingDB Entry DOI: 10.7270/Q2NZ88DW
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 6 (5-HT6)


(Homo sapiens (Human))
BDBM50131440
PNG
(10-(2-(1-methylpiperidin-2-yl)ethyl)-2-(methylsulf...)
Show SMILES CN1CCCCC1CCN1c2ccccc2Sc2ccc(cc12)S(C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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380n/an/an/an/an/an/an/an/a



University of Washington

Curated by PDSP Ki Database




J Neurochem 66: 47-56 (1996)


BindingDB Entry DOI: 10.7270/Q20K2721
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50370414
PNG
(CHEMBL611207 | MESORIDAZINE)
Show SMILES CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3/t16-,26+/m1/s1
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395n/an/an/an/an/an/an/an/a



Brigham& Women's Hospital

Curated by ChEMBL


Assay Description
Binding affinity towards human 5-hydroxytryptamine 1A receptor was determined by using [3H]8-OH-DPAT as radioligand


Bioorg Med Chem Lett 14: 4379-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.078
BindingDB Entry DOI: 10.7270/Q2NZ88DW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50370414
PNG
(CHEMBL611207 | MESORIDAZINE)
Show SMILES CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3/t16-,26+/m1/s1
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395n/an/an/an/an/an/an/an/a



Brigham& Women's Hospital

Curated by ChEMBL


Assay Description
Binding affinity towards human 5-hydroxytryptamine 1A receptor was determined by using [3H]8-OH-DPAT as radioligand


Bioorg Med Chem Lett 14: 4379-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.078
BindingDB Entry DOI: 10.7270/Q2NZ88DW
More data for this
Ligand-Target Pair
Serotonin receptor 2a and 2c (5HT2A and 5HT2C)


(Rattus norvegicus (Rat))
BDBM50370414
PNG
(CHEMBL611207 | MESORIDAZINE)
Show SMILES CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3/t16-,26+/m1/s1
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412n/an/an/an/an/an/an/an/a



Brigham& Women's Hospital

Curated by ChEMBL


Assay Description
Binding affinity towards rat 5-hydroxytryptamine 2C receptor was determined by using [3H]mesulergine as radioligand


Bioorg Med Chem Lett 14: 4379-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.078
BindingDB Entry DOI: 10.7270/Q2NZ88DW
More data for this
Ligand-Target Pair
Serotonin receptor 2a and 2c (5HT2A and 5HT2C)


(Rattus norvegicus (Rat))
BDBM50370414
PNG
(CHEMBL611207 | MESORIDAZINE)
Show SMILES CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3/t16-,26+/m1/s1
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412n/an/an/an/an/an/an/an/a



Brigham& Women's Hospital

Curated by ChEMBL


Assay Description
Binding affinity towards rat 5-hydroxytryptamine 2C receptor was determined by using [3H]mesulergine as radioligand


Bioorg Med Chem Lett 14: 4379-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.078
BindingDB Entry DOI: 10.7270/Q2NZ88DW
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50370414
PNG
(CHEMBL611207 | MESORIDAZINE)
Show SMILES CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3/t16-,26+/m1/s1
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414n/an/an/an/an/an/an/an/a



Brigham& Women's Hospital

Curated by ChEMBL


Assay Description
Binding affinity towards rat 5-hydroxytryptamine 2A receptor was determined by using [3H]-ketanserin as radioligand


Bioorg Med Chem Lett 14: 4379-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.078
BindingDB Entry DOI: 10.7270/Q2NZ88DW
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50370414
PNG
(CHEMBL611207 | MESORIDAZINE)
Show SMILES CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3/t16-,26+/m1/s1
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414n/an/an/an/an/an/an/an/a



Brigham& Women's Hospital

Curated by ChEMBL


Assay Description
Binding affinity towards rat 5-hydroxytryptamine 2A receptor was determined by using [3H]-ketanserin as radioligand


Bioorg Med Chem Lett 14: 4379-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.078
BindingDB Entry DOI: 10.7270/Q2NZ88DW
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50370414
PNG
(CHEMBL611207 | MESORIDAZINE)
Show SMILES CN1CCCC[C@@H]1CCN1c2ccccc2Sc2ccc(cc12)[S@](C)=O
Show InChI InChI=1S/C21H26N2OS2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(26(2)24)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3/t16-,26+/m1/s1
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426n/an/an/an/an/an/an/an/a



Brigham& Women's Hospital

Curated by ChEMBL


Assay Description
Binding affinity towards human D2 dopamine receptor was determined by using [3H]YM-09151-2 as radioligand


Bioorg Med Chem Lett 14: 4379-82 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.078
BindingDB Entry DOI: 10.7270/Q2NZ88DW
More data for this
Ligand-Target Pair
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