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PubMed code 28029458

Compile data set for download or QSAR
Found 50 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
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50207038
PNG
(CHEMBL3961596)
Show SMILES CNCC1Cc2cc3ccn(c3cc12)S(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C22H20N2O2S/c1-23-14-18-12-17-11-16-9-10-24(21(16)13-20(17)18)27(25,26)22-8-4-6-15-5-2-3-7-19(15)22/h2-11,13,18,23H,12,14H2,1H3
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 1n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50206981
PNG
(CHEMBL3948819)
Show SMILES CNCC1Cc2ccc3n(ccc3c12)S(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C22H20N2O2S/c1-23-14-17-13-16-9-10-20-19(22(16)17)11-12-24(20)27(25,26)21-8-4-6-15-5-2-3-7-18(15)21/h2-12,17,23H,13-14H2,1H3
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 1n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50207046
PNG
(CHEMBL3929918)
Show SMILES CNCC1Cc2ccc3n(ccc3c12)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C18H18N2O2S/c1-19-12-14-11-13-7-8-17-16(18(13)14)9-10-20(17)23(21,22)15-5-3-2-4-6-15/h2-10,14,19H,11-12H2,1H3
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 1.60n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50207039
PNG
(CHEMBL3890882)
Show SMILES CN[C@H]1[C@H](CCO)c2cc3n(ccc3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(8-10-22)16-12-18-13(11-17(16)19)7-9-21(18)25(23,24)14-5-3-2-4-6-14/h2-7,9,11-12,15,19-20,22H,8,10H2,1H3/t15-,19+/m1/s1
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 4n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50207042
PNG
(CHEMBL3895173)
Show SMILES CN[C@@H]1[C@H](CCO)c2ccc3n(ccc3c12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(10-12-22)14-7-8-17-16(18(14)19)9-11-21(17)25(23,24)13-5-3-2-4-6-13/h2-9,11,15,19-20,22H,10,12H2,1H3/t15-,19-/m1/s1
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 7.90n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50207043
PNG
(CHEMBL3959964)
Show SMILES CN[C@@H]1[C@H](CCO)c2cc3n(ccc3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(8-10-22)16-12-18-13(11-17(16)19)7-9-21(18)25(23,24)14-5-3-2-4-6-14/h2-7,9,11-12,15,19-20,22H,8,10H2,1H3/t15-,19-/m1/s1
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 10n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50207045
PNG
(CHEMBL3944687)
Show SMILES CN(C)[C@H]1[C@H](CCO)c2cc3n(ccc3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C20H22N2O3S/c1-21(2)20-16(9-11-23)17-13-19-14(12-18(17)20)8-10-22(19)26(24,25)15-6-4-3-5-7-15/h3-8,10,12-13,16,20,23H,9,11H2,1-2H3/t16-,20+/m1/s1
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 13n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50206983
PNG
(CHEMBL3908917)
Show SMILES CN[C@H]1[C@@H](CCO)c2c1ccc1n(ccc21)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15-7-8-17-14(18(15)16(19)10-12-22)9-11-21(17)25(23,24)13-5-3-2-4-6-13/h2-9,11,16,19-20,22H,10,12H2,1H3/t16-,19+/m0/s1
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 25n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50207044
PNG
(CHEMBL3916787)
Show SMILES CN(C)[C@@H]1[C@H](CCO)c2cc3n(ccc3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C20H22N2O3S/c1-21(2)20-16(9-11-23)17-13-19-14(12-18(17)20)8-10-22(19)26(24,25)15-6-4-3-5-7-15/h3-8,10,12-13,16,20,23H,9,11H2,1-2H3/t16-,20-/m1/s1
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 40n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50207037
PNG
(CHEMBL3889852)
Show SMILES [H][C@]12CCNCC[C@@]1([H])c1c2ccc2n(ccc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C20H20N2O2S/c23-25(24,14-4-2-1-3-5-14)22-13-10-18-19(22)7-6-16-15-8-11-21-12-9-17(15)20(16)18/h1-7,10,13,15,17,21H,8-9,11-12H2/t15-,17-/m1/s1
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 50n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50207047
PNG
(CHEMBL3910287)
Show SMILES CN(CCc1ccc(NC(C)=O)cc1)CC1Cc2ccc3n(ccc3c12)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C28H29N3O3S/c1-20(32)29-24-11-8-21(9-12-24)14-16-30(2)19-23-18-22-10-13-27-26(28(22)23)15-17-31(27)35(33,34)25-6-4-3-5-7-25/h3-13,15,17,23H,14,16,18-19H2,1-2H3,(H,29,32)
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 79n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50207049
PNG
(CHEMBL3919497)
Show SMILES CN(C)[C@@H]1[C@@H](CCO)c2cc3ccn(c3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C20H22N2O3S/c1-21(2)20-16(9-11-23)17-12-14-8-10-22(19(14)13-18(17)20)26(24,25)15-6-4-3-5-7-15/h3-8,10,12-13,16,20,23H,9,11H2,1-2H3/t16-,20+/m0/s1
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 126n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50206982
PNG
(CHEMBL3971039)
Show SMILES CN[C@H]1[C@@H](CCO)c2cc3ccn(c3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(8-10-22)16-11-13-7-9-21(18(13)12-17(16)19)25(23,24)14-5-3-2-4-6-14/h2-7,9,11-12,15,19-20,22H,8,10H2,1H3/t15-,19-/m0/s1
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 126n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50207041
PNG
(CHEMBL3938498)
Show SMILES [H][C@@]12CCNCC[C@]1([H])c1cc3n(ccc3cc21)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C20H20N2O2S/c23-25(24,15-4-2-1-3-5-15)22-11-8-14-12-18-16-6-9-21-10-7-17(16)19(18)13-20(14)22/h1-5,8,11-13,16-17,21H,6-7,9-10H2/t16-,17+/m1/s1
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 158n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50206980
PNG
(CHEMBL3979230)
Show SMILES CN[C@@H]1[C@@H](CCO)c2c1ccc1n(ccc21)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15-7-8-17-14(18(15)16(19)10-12-22)9-11-21(17)25(23,24)13-5-3-2-4-6-13/h2-9,11,16,19-20,22H,10,12H2,1H3/t16-,19-/m0/s1
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 158n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50207040
PNG
(CHEMBL3963688)
Show SMILES CN[C@@H]1[C@@H](CCO)c2cc3ccn(c3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(8-10-22)16-11-13-7-9-21(18(13)12-17(16)19)25(23,24)14-5-3-2-4-6-14/h2-7,9,11-12,15,19-20,22H,8,10H2,1H3/t15-,19+/m0/s1
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 158n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50207036
PNG
(CHEMBL3966484)
Show SMILES CN[C@@H]1[C@@H](CCO)c2ccc3n(ccc3c12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(10-12-22)14-7-8-17-16(18(14)19)9-11-21(17)25(23,24)13-5-3-2-4-6-13/h2-9,11,15,19-20,22H,10,12H2,1H3/t15-,19+/m0/s1
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 200n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50207047
PNG
(CHEMBL3910287)
Show SMILES CN(CCc1ccc(NC(C)=O)cc1)CC1Cc2ccc3n(ccc3c12)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C28H29N3O3S/c1-20(32)29-24-11-8-21(9-12-24)14-16-30(2)19-23-18-22-10-13-27-26(28(22)23)15-17-31(27)35(33,34)25-6-4-3-5-7-25/h3-13,15,17,23H,14,16,18-19H2,1-2H3,(H,29,32)
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 251n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D2L receptor expressed in HEK293 cell membranes after 1 hr by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50207040
PNG
(CHEMBL3963688)
Show SMILES CN[C@@H]1[C@@H](CCO)c2cc3ccn(c3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(8-10-22)16-11-13-7-9-21(18(13)12-17(16)19)25(23,24)14-5-3-2-4-6-14/h2-7,9,11-12,15,19-20,22H,8,10H2,1H3/t15-,19+/m0/s1
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 251n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50206981
PNG
(CHEMBL3948819)
Show SMILES CNCC1Cc2ccc3n(ccc3c12)S(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C22H20N2O2S/c1-23-14-17-13-16-9-10-20-19(22(16)17)11-12-24(20)27(25,26)21-8-4-6-15-5-2-3-7-18(15)21/h2-12,17,23H,13-14H2,1H3
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 251n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50207048
PNG
(CHEMBL3947289)
Show SMILES CN(C)[C@H]1[C@@H](CCO)c2cc3ccn(c3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C20H22N2O3S/c1-21(2)20-16(9-11-23)17-12-14-8-10-22(19(14)13-18(17)20)26(24,25)15-6-4-3-5-7-15/h3-8,10,12-13,16,20,23H,9,11H2,1-2H3/t16-,20-/m0/s1
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 316n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))		BDBM50207049
PNG
(CHEMBL3919497)
Show SMILES CN(C)[C@@H]1[C@@H](CCO)c2cc3ccn(c3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C20H22N2O3S/c1-21(2)20-16(9-11-23)17-12-14-8-10-22(19(14)13-18(17)20)26(24,25)15-6-4-3-5-7-15/h3-8,10,12-13,16,20,23H,9,11H2,1-2H3/t16-,20+/m0/s1
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 316n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50207044
PNG
(CHEMBL3916787)
Show SMILES CN(C)[C@@H]1[C@H](CCO)c2cc3n(ccc3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C20H22N2O3S/c1-21(2)20-16(9-11-23)17-13-19-14(12-18(17)20)8-10-22(19)26(24,25)15-6-4-3-5-7-15/h3-8,10,12-13,16,20,23H,9,11H2,1-2H3/t16-,20-/m1/s1
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 398n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50207047
PNG
(CHEMBL3910287)
Show SMILES CN(CCc1ccc(NC(C)=O)cc1)CC1Cc2ccc3n(ccc3c12)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C28H29N3O3S/c1-20(32)29-24-11-8-21(9-12-24)14-16-30(2)19-23-18-22-10-13-27-26(28(22)23)15-17-31(27)35(33,34)25-6-4-3-5-7-25/h3-13,15,17,23H,14,16,18-19H2,1-2H3,(H,29,32)
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 501n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50207048
PNG
(CHEMBL3947289)
Show SMILES CN(C)[C@H]1[C@@H](CCO)c2cc3ccn(c3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C20H22N2O3S/c1-21(2)20-16(9-11-23)17-12-14-8-10-22(19(14)13-18(17)20)26(24,25)15-6-4-3-5-7-15/h3-8,10,12-13,16,20,23H,9,11H2,1-2H3/t16-,20-/m0/s1
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 631n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50207037
PNG
(CHEMBL3889852)
Show SMILES [H][C@]12CCNCC[C@@]1([H])c1c2ccc2n(ccc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C20H20N2O2S/c23-25(24,14-4-2-1-3-5-14)22-13-10-18-19(22)7-6-16-15-8-11-21-12-9-17(15)20(16)18/h1-7,10,13,15,17,21H,8-9,11-12H2/t15-,17-/m1/s1
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 794n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D2L receptor expressed in HEK293 cell membranes after 1 hr by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50207038
PNG
(CHEMBL3961596)
Show SMILES CNCC1Cc2cc3ccn(c3cc12)S(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C22H20N2O2S/c1-23-14-18-12-17-11-16-9-10-24(21(16)13-20(17)18)27(25,26)22-8-4-6-15-5-2-3-7-19(15)22/h2-11,13,18,23H,12,14H2,1H3
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 794n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50206982
PNG
(CHEMBL3971039)
Show SMILES CN[C@H]1[C@@H](CCO)c2cc3ccn(c3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(8-10-22)16-11-13-7-9-21(18(13)12-17(16)19)25(23,24)14-5-3-2-4-6-14/h2-7,9,11-12,15,19-20,22H,8,10H2,1H3/t15-,19-/m0/s1
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 1.00E+3n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50206981
PNG
(CHEMBL3948819)
Show SMILES CNCC1Cc2ccc3n(ccc3c12)S(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C22H20N2O2S/c1-23-14-17-13-16-9-10-20-19(22(16)17)11-12-24(20)27(25,26)21-8-4-6-15-5-2-3-7-18(15)21/h2-12,17,23H,13-14H2,1H3
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 1.00E+3n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D2L receptor expressed in HEK293 cell membranes after 1 hr by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50207037
PNG
(CHEMBL3889852)
Show SMILES [H][C@]12CCNCC[C@@]1([H])c1c2ccc2n(ccc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C20H20N2O2S/c23-25(24,14-4-2-1-3-5-14)22-13-10-18-19(22)7-6-16-15-8-11-21-12-9-17(15)20(16)18/h1-7,10,13,15,17,21H,8-9,11-12H2/t15-,17-/m1/s1
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 1.00E+3n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50207043
PNG
(CHEMBL3959964)
Show SMILES CN[C@@H]1[C@H](CCO)c2cc3n(ccc3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(8-10-22)16-12-18-13(11-17(16)19)7-9-21(18)25(23,24)14-5-3-2-4-6-14/h2-7,9,11-12,15,19-20,22H,8,10H2,1H3/t15-,19-/m1/s1
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 1.26E+3n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50207045
PNG
(CHEMBL3944687)
Show SMILES CN(C)[C@H]1[C@H](CCO)c2cc3n(ccc3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C20H22N2O3S/c1-21(2)20-16(9-11-23)17-13-19-14(12-18(17)20)8-10-22(19)26(24,25)15-6-4-3-5-7-15/h3-8,10,12-13,16,20,23H,9,11H2,1-2H3/t16-,20+/m1/s1
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 1.26E+3n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50207036
PNG
(CHEMBL3966484)
Show SMILES CN[C@@H]1[C@@H](CCO)c2ccc3n(ccc3c12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(10-12-22)14-7-8-17-16(18(14)19)9-11-21(17)25(23,24)13-5-3-2-4-6-13/h2-9,11,15,19-20,22H,10,12H2,1H3/t15-,19+/m0/s1
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 1.26E+3n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50207046
PNG
(CHEMBL3929918)
Show SMILES CNCC1Cc2ccc3n(ccc3c12)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C18H18N2O2S/c1-19-12-14-11-13-7-8-17-16(18(13)14)9-10-20(17)23(21,22)15-5-3-2-4-6-15/h2-10,14,19H,11-12H2,1H3
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 1.26E+3n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50206980
PNG
(CHEMBL3979230)
Show SMILES CN[C@@H]1[C@@H](CCO)c2c1ccc1n(ccc21)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15-7-8-17-14(18(15)16(19)10-12-22)9-11-21(17)25(23,24)13-5-3-2-4-6-13/h2-9,11,16,19-20,22H,10,12H2,1H3/t16-,19-/m0/s1
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 1.26E+3n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50207039
PNG
(CHEMBL3890882)
Show SMILES CN[C@H]1[C@H](CCO)c2cc3n(ccc3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(8-10-22)16-12-18-13(11-17(16)19)7-9-21(18)25(23,24)14-5-3-2-4-6-14/h2-7,9,11-12,15,19-20,22H,8,10H2,1H3/t15-,19+/m1/s1
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 2.00E+3n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50207046
PNG
(CHEMBL3929918)
Show SMILES CNCC1Cc2ccc3n(ccc3c12)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C18H18N2O2S/c1-19-12-14-11-13-7-8-17-16(18(13)14)9-10-20(17)23(21,22)15-5-3-2-4-6-15/h2-10,14,19H,11-12H2,1H3
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 2.00E+3n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D2L receptor expressed in HEK293 cell membranes after 1 hr by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50207038
PNG
(CHEMBL3961596)
Show SMILES CNCC1Cc2cc3ccn(c3cc12)S(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C22H20N2O2S/c1-23-14-18-12-17-11-16-9-10-24(21(16)13-20(17)18)27(25,26)22-8-4-6-15-5-2-3-7-19(15)22/h2-11,13,18,23H,12,14H2,1H3
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 2.51E+3n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D2L receptor expressed in HEK293 cell membranes after 1 hr by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50207041
PNG
(CHEMBL3938498)
Show SMILES [H][C@@]12CCNCC[C@]1([H])c1cc3n(ccc3cc21)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C20H20N2O2S/c23-25(24,15-4-2-1-3-5-15)22-11-8-14-12-18-16-6-9-21-10-7-17(16)19(18)13-20(14)22/h1-5,8,11-13,16-17,21H,6-7,9-10H2/t16-,17+/m1/s1
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 3.16E+3n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50207040
PNG
(CHEMBL3963688)
Show SMILES CN[C@@H]1[C@@H](CCO)c2cc3ccn(c3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(8-10-22)16-11-13-7-9-21(18(13)12-17(16)19)25(23,24)14-5-3-2-4-6-14/h2-7,9,11-12,15,19-20,22H,8,10H2,1H3/t15-,19+/m0/s1
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 6.31E+3n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D2L receptor expressed in HEK293 cell membranes after 1 hr by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50207041
PNG
(CHEMBL3938498)
Show SMILES [H][C@@]12CCNCC[C@]1([H])c1cc3n(ccc3cc21)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C20H20N2O2S/c23-25(24,15-4-2-1-3-5-15)22-11-8-14-12-18-16-6-9-21-10-7-17(16)19(18)13-20(14)22/h1-5,8,11-13,16-17,21H,6-7,9-10H2/t16-,17+/m1/s1
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<1.00E+4n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D2L receptor expressed in HEK293 cell membranes after 1 hr by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50206983
PNG
(CHEMBL3908917)
Show SMILES CN[C@H]1[C@@H](CCO)c2c1ccc1n(ccc21)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15-7-8-17-14(18(15)16(19)10-12-22)9-11-21(17)25(23,24)13-5-3-2-4-6-13/h2-9,11,16,19-20,22H,10,12H2,1H3/t16-,19+/m0/s1
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<1.00E+4n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D2L receptor expressed in HEK293 cell membranes after 1 hr by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50206983
PNG
(CHEMBL3908917)
Show SMILES CN[C@H]1[C@@H](CCO)c2c1ccc1n(ccc21)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15-7-8-17-14(18(15)16(19)10-12-22)9-11-21(17)25(23,24)13-5-3-2-4-6-13/h2-9,11,16,19-20,22H,10,12H2,1H3/t16-,19+/m0/s1
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<1.00E+4n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))		BDBM50207042
PNG
(CHEMBL3895173)
Show SMILES CN[C@@H]1[C@H](CCO)c2ccc3n(ccc3c12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(10-12-22)14-7-8-17-16(18(14)19)9-11-21(17)25(23,24)13-5-3-2-4-6-13/h2-9,11,15,19-20,22H,10,12H2,1H3/t15-,19-/m1/s1
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<1.00E+4n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50207042
PNG
(CHEMBL3895173)
Show SMILES CN[C@@H]1[C@H](CCO)c2ccc3n(ccc3c12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(10-12-22)14-7-8-17-16(18(14)19)9-11-21(17)25(23,24)13-5-3-2-4-6-13/h2-9,11,15,19-20,22H,10,12H2,1H3/t15-,19-/m1/s1
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<1.00E+4n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D2L receptor expressed in HEK293 cell membranes after 1 hr by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50206980
PNG
(CHEMBL3979230)
Show SMILES CN[C@@H]1[C@@H](CCO)c2c1ccc1n(ccc21)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15-7-8-17-14(18(15)16(19)10-12-22)9-11-21(17)25(23,24)13-5-3-2-4-6-13/h2-9,11,16,19-20,22H,10,12H2,1H3/t16-,19-/m0/s1
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<1.00E+4n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D2L receptor expressed in HEK293 cell membranes after 1 hr by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50206982
PNG
(CHEMBL3971039)
Show SMILES CN[C@H]1[C@@H](CCO)c2cc3ccn(c3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(8-10-22)16-11-13-7-9-21(18(13)12-17(16)19)25(23,24)14-5-3-2-4-6-14/h2-7,9,11-12,15,19-20,22H,8,10H2,1H3/t15-,19-/m0/s1
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<1.00E+4n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D2L receptor expressed in HEK293 cell membranes after 1 hr by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50207044
PNG
(CHEMBL3916787)
Show SMILES CN(C)[C@@H]1[C@H](CCO)c2cc3n(ccc3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C20H22N2O3S/c1-21(2)20-16(9-11-23)17-13-19-14(12-18(17)20)8-10-22(19)26(24,25)15-6-4-3-5-7-15/h3-8,10,12-13,16,20,23H,9,11H2,1-2H3/t16-,20-/m1/s1
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<1.00E+4n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D2L receptor expressed in HEK293 cell membranes after 1 hr by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50207039
PNG
(CHEMBL3890882)
Show SMILES CN[C@H]1[C@H](CCO)c2cc3n(ccc3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(8-10-22)16-12-18-13(11-17(16)19)7-9-21(18)25(23,24)14-5-3-2-4-6-14/h2-7,9,11-12,15,19-20,22H,8,10H2,1H3/t15-,19+/m1/s1
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 1.58E+4n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D2L receptor expressed in HEK293 cell membranes after 1 hr by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))		BDBM50207036
PNG
(CHEMBL3966484)
Show SMILES CN[C@@H]1[C@@H](CCO)c2ccc3n(ccc3c12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(10-12-22)14-7-8-17-16(18(14)19)9-11-21(17)25(23,24)13-5-3-2-4-6-13/h2-9,11,15,19-20,22H,10,12H2,1H3/t15-,19+/m0/s1
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 1.58E+4n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D2L receptor expressed in HEK293 cell membranes after 1 hr by radioligand binding assay

Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%