Compile Data Set for Download or QSAR

Found 37 hits Enz. Inhib. hit(s) with all data for entry = 50000460   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
D(2) dopamine receptor (Homo sapiens (Human))	BDBM21397 (8-[4-(4-fluorophenyl)-4-keto-butyl]-1-phenyl-1,3,8...) Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)N(CNC2=O)c1ccccc1 Show InChI InChI=1S/C23H26FN3O2/c24-19-10-8-18(9-11-19)21(28)7-4-14-26-15-12-23(13-16-26)22(29)25-17-27(23)20-5-2-1-3-6-20/h1-3,5-6,8-11H,4,7,12-17H2,(H,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	0.0600	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D2 long receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50250803 (CHEMBL4083252) Show SMILES COc1ccccc1N1CCN(CCCSc2nnc(-c3ccccc3)n2C)CC1 Show InChI InChI=1S/C23H29N5OS/c1-26-22(19-9-4-3-5-10-19)24-25-23(26)30-18-8-13-27-14-16-28(17-15-27)20-11-6-7-12-21(20)29-2/h3-7,9-12H,8,13-18H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	0.220	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from human 5-HT1A receptor expressed in CHO-K1 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM21397 (8-[4-(4-fluorophenyl)-4-keto-butyl]-1-phenyl-1,3,8...) Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)N(CNC2=O)c1ccccc1 Show InChI InChI=1S/C23H26FN3O2/c24-19-10-8-18(9-11-19)21(28)7-4-14-26-15-12-23(13-16-26)22(29)25-17-27(23)20-5-2-1-3-6-20/h1-3,5-6,8-11H,4,7,12-17H2,(H,25,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	0.330	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D3 receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM21397 (8-[4-(4-fluorophenyl)-4-keto-butyl]-1-phenyl-1,3,8...) Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)N(CNC2=O)c1ccccc1 Show InChI InChI=1S/C23H26FN3O2/c24-19-10-8-18(9-11-19)21(28)7-4-14-26-15-12-23(13-16-26)22(29)25-17-27(23)20-5-2-1-3-6-20/h1-3,5-6,8-11H,4,7,12-17H2,(H,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	0.450	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Binding affinity to dopamine D4 receptor (unknown origin)				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50250803 (CHEMBL4083252) Show SMILES COc1ccccc1N1CCN(CCCSc2nnc(-c3ccccc3)n2C)CC1 Show InChI InChI=1S/C23H29N5OS/c1-26-22(19-9-4-3-5-10-19)24-25-23(26)30-18-8-13-27-14-16-28(17-15-27)20-11-6-7-12-21(20)29-2/h3-7,9-12H,8,13-18H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	6.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D3 receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50250795 (CHEMBL4084262) Show SMILES COc1ccccc1N1CCC2(CCN(CCCSc3nnc(-c4ccccc4)n3C)CC2)CC1 Show InChI InChI=1S/C28H37N5OS/c1-31-26(23-9-4-3-5-10-23)29-30-27(31)35-22-8-17-32-18-13-28(14-19-32)15-20-33(21-16-28)24-11-6-7-12-25(24)34-2/h3-7,9-12H,8,13-22H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D3 receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50250797 (CHEMBL4062553) Show SMILES COc1ccccc1N1CCC2(C1)CCN(CCCSc1nnc(-c3ccccc3)n1C)CC2 Show InChI InChI=1S/C27H35N5OS/c1-30-25(22-9-4-3-5-10-22)28-29-26(30)34-20-8-16-31-17-13-27(14-18-31)15-19-32(21-27)23-11-6-7-12-24(23)33-2/h3-7,9-12H,8,13-21H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D3 receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50250799 (CHEMBL4076516) Show SMILES COc1ccccc1N1CCC2(CCN(CCCSc3nnc(-c4ccccc4)n3C)C2)C1 Show InChI InChI=1S/C26H33N5OS/c1-29-24(21-9-4-3-5-10-21)27-28-25(29)33-18-8-15-30-16-13-26(19-30)14-17-31(20-26)22-11-6-7-12-23(22)32-2/h3-7,9-12H,8,13-20H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D3 receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50250807 (CHEMBL4073927) Show SMILES Cn1c(SCCCN2CCC3(CC2)CCN(CC3)c2ccc(F)cc2)nnc1-c1ccccc1 Show InChI InChI=1S/C27H34FN5S/c1-31-25(22-6-3-2-4-7-22)29-30-26(31)34-21-5-16-32-17-12-27(13-18-32)14-19-33(20-15-27)24-10-8-23(28)9-11-24/h2-4,6-11H,5,12-21H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	26	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D3 receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50250804 (CHEMBL4101993) Show SMILES Cn1c(SCCCN2CCC3(CC2)CCN(CC3)c2cccc(Cl)c2Cl)nnc1-c1ccccc1 Show InChI InChI=1S/C27H33Cl2N5S/c1-32-25(21-7-3-2-4-8-21)30-31-26(32)35-20-6-15-33-16-11-27(12-17-33)13-18-34(19-14-27)23-10-5-9-22(28)24(23)29/h2-5,7-10H,6,11-20H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	82	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D3 receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50250809 (CHEMBL4100699) Show SMILES COc1ccc(cc1)N1CCC2(CCN(CCCSc3nnc(-c4ccccc4)n3C)CC2)CC1 Show InChI InChI=1S/C28H37N5OS/c1-31-26(23-7-4-3-5-8-23)29-30-27(31)35-22-6-17-32-18-13-28(14-19-32)15-20-33(21-16-28)24-9-11-25(34-2)12-10-24/h3-5,7-12H,6,13-22H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	98	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D3 receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50250810 (CHEMBL4092015) Show SMILES COc1ccccc1N1CCC11CCN(CCCSc2nnc(-c3ccccc3)n2C)CC1 Show InChI InChI=1S/C26H33N5OS/c1-29-24(21-9-4-3-5-10-21)27-28-25(29)33-20-8-16-30-17-13-26(14-18-30)15-19-31(26)22-11-6-7-12-23(22)32-2/h3-7,9-12H,8,13-20H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	169	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D3 receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50250811 (CHEMBL4089290) Show SMILES COc1ccccc1N1CCC2(CN(CCCSc3nnc(-c4ccccc4)n3C)C2)C1 Show InChI InChI=1S/C25H31N5OS/c1-28-23(20-9-4-3-5-10-20)26-27-24(28)32-16-8-14-29-17-25(18-29)13-15-30(19-25)21-11-6-7-12-22(21)31-2/h3-7,9-12H,8,13-19H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	192	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D3 receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50250798 (CHEMBL4071189) Show SMILES COc1ccccc1N1CC2(C1)CCN(CCCSc1nnc(-c3ccccc3)n1C)CC2 Show InChI InChI=1S/C26H33N5OS/c1-29-24(21-9-4-3-5-10-21)27-28-25(29)33-18-8-15-30-16-13-26(14-17-30)19-31(20-26)22-11-6-7-12-23(22)32-2/h3-7,9-12H,8,13-20H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	235	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D3 receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50250803 (CHEMBL4083252) Show SMILES COc1ccccc1N1CCN(CCCSc2nnc(-c3ccccc3)n2C)CC1 Show InChI InChI=1S/C23H29N5OS/c1-26-22(19-9-4-3-5-10-19)24-25-23(26)30-18-8-13-27-14-16-28(17-15-27)20-11-6-7-12-21(20)29-2/h3-7,9-12H,8,13-18H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	260	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D2 long receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50250805 (CHEMBL4076086) Show SMILES Cn1c(SCCCN2CCC3(CC2)CCN(CC3)c2cccc(c2)C#N)nnc1-c1ccccc1 Show InChI InChI=1S/C28H34N6S/c1-32-26(24-8-3-2-4-9-24)30-31-27(32)35-20-6-15-33-16-11-28(12-17-33)13-18-34(19-14-28)25-10-5-7-23(21-25)22-29/h2-5,7-10,21H,6,11-20H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	438	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D3 receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50250807 (CHEMBL4073927) Show SMILES Cn1c(SCCCN2CCC3(CC2)CCN(CC3)c2ccc(F)cc2)nnc1-c1ccccc1 Show InChI InChI=1S/C27H34FN5S/c1-31-25(22-6-3-2-4-7-22)29-30-26(31)34-21-5-16-32-17-12-27(13-18-32)14-19-33(20-15-27)24-10-8-23(28)9-11-24/h2-4,6-11H,5,12-21H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	587	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from human 5-HT1A receptor expressed in CHO-K1 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50250797 (CHEMBL4062553) Show SMILES COc1ccccc1N1CCC2(C1)CCN(CCCSc1nnc(-c3ccccc3)n1C)CC2 Show InChI InChI=1S/C27H35N5OS/c1-30-25(22-9-4-3-5-10-22)28-29-26(30)34-20-8-16-31-17-13-27(14-18-31)15-19-32(21-27)23-11-6-7-12-24(23)33-2/h3-7,9-12H,8,13-21H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	724	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from human 5-HT1A receptor expressed in CHO-K1 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50250802 (CHEMBL4077251) Show SMILES COc1ccccc1N1CC2(CN(CCCSc3nnc(-c4ccccc4)n3C)C2)C1 Show InChI InChI=1S/C24H29N5OS/c1-27-22(19-9-4-3-5-10-19)25-26-23(27)31-14-8-13-28-15-24(16-28)17-29(18-24)20-11-6-7-12-21(20)30-2/h3-7,9-12H,8,13-18H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	833	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D3 receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50250806 (CHEMBL4076527) Show SMILES Cn1c(SCCCN2CCC3(CC2)CCN(CC3)c2ccccn2)nnc1-c1ccccc1 Show InChI InChI=1S/C26H34N6S/c1-30-24(22-8-3-2-4-9-22)28-29-25(30)33-21-7-16-31-17-11-26(12-18-31)13-19-32(20-14-26)23-10-5-6-15-27-23/h2-6,8-10,15H,7,11-14,16-21H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	871	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D3 receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50250795 (CHEMBL4084262) Show SMILES COc1ccccc1N1CCC2(CCN(CCCSc3nnc(-c4ccccc4)n3C)CC2)CC1 Show InChI InChI=1S/C28H37N5OS/c1-31-26(23-9-4-3-5-10-23)29-30-27(31)35-22-8-17-32-18-13-28(14-19-32)15-20-33(21-16-28)24-11-6-7-12-25(24)34-2/h3-7,9-12H,8,13-22H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	931	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from human 5-HT1A receptor expressed in CHO-K1 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50250801 (CHEMBL4079642) Show SMILES COc1ccccc1N1CCC11CN(CCCSc2nnc(-c3ccccc3)n2C)C1 Show InChI InChI=1S/C24H29N5OS/c1-27-22(19-9-4-3-5-10-19)25-26-23(27)31-16-8-14-28-17-24(18-28)13-15-29(24)20-11-6-7-12-21(20)30-2/h3-7,9-12H,8,13-18H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4.79E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D3 receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50250797 (CHEMBL4062553) Show SMILES COc1ccccc1N1CCC2(C1)CCN(CCCSc1nnc(-c3ccccc3)n1C)CC2 Show InChI InChI=1S/C27H35N5OS/c1-30-25(22-9-4-3-5-10-22)28-29-26(30)34-20-8-16-31-17-13-27(14-18-31)15-19-32(21-27)23-11-6-7-12-24(23)33-2/h3-7,9-12H,8,13-21H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	6.17E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D2 long receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50250799 (CHEMBL4076516) Show SMILES COc1ccccc1N1CCC2(CCN(CCCSc3nnc(-c4ccccc4)n3C)C2)C1 Show InChI InChI=1S/C26H33N5OS/c1-29-24(21-9-4-3-5-10-21)27-28-25(29)33-18-8-15-30-16-13-26(19-30)14-17-31(20-26)22-11-6-7-12-23(22)32-2/h3-7,9-12H,8,13-20H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	6.37E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D2 long receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50250804 (CHEMBL4101993) Show SMILES Cn1c(SCCCN2CCC3(CC2)CCN(CC3)c2cccc(Cl)c2Cl)nnc1-c1ccccc1 Show InChI InChI=1S/C27H33Cl2N5S/c1-32-25(21-7-3-2-4-8-21)30-31-26(32)35-20-6-15-33-16-11-27(12-17-33)13-18-34(19-14-27)23-10-5-9-22(28)24(23)29/h2-5,7-10H,6,11-20H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	7.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D2 long receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50250807 (CHEMBL4073927) Show SMILES Cn1c(SCCCN2CCC3(CC2)CCN(CC3)c2ccc(F)cc2)nnc1-c1ccccc1 Show InChI InChI=1S/C27H34FN5S/c1-31-25(22-6-3-2-4-7-22)29-30-26(31)34-21-5-16-32-17-12-27(13-18-32)14-19-33(20-15-27)24-10-8-23(28)9-11-24/h2-4,6-11H,5,12-21H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	9.79E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D2 long receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50250795 (CHEMBL4084262) Show SMILES COc1ccccc1N1CCC2(CCN(CCCSc3nnc(-c4ccccc4)n3C)CC2)CC1 Show InChI InChI=1S/C28H37N5OS/c1-31-26(23-9-4-3-5-10-23)29-30-27(31)35-22-8-17-32-18-13-28(14-19-32)15-20-33(21-16-28)24-11-6-7-12-25(24)34-2/h3-7,9-12H,8,13-22H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.09E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D2 long receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50250802 (CHEMBL4077251) Show SMILES COc1ccccc1N1CC2(CN(CCCSc3nnc(-c4ccccc4)n3C)C2)C1 Show InChI InChI=1S/C24H29N5OS/c1-27-22(19-9-4-3-5-10-19)25-26-23(27)31-14-8-13-28-15-24(16-28)17-29(18-24)20-11-6-7-12-21(20)30-2/h3-7,9-12H,8,13-18H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.12E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D2 long receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50250810 (CHEMBL4092015) Show SMILES COc1ccccc1N1CCC11CCN(CCCSc2nnc(-c3ccccc3)n2C)CC1 Show InChI InChI=1S/C26H33N5OS/c1-29-24(21-9-4-3-5-10-21)27-28-25(29)33-20-8-16-30-17-13-26(14-18-30)15-19-31(26)22-11-6-7-12-23(22)32-2/h3-7,9-12H,8,13-20H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	2.93E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D2 long receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50250798 (CHEMBL4071189) Show SMILES COc1ccccc1N1CC2(C1)CCN(CCCSc1nnc(-c3ccccc3)n1C)CC2 Show InChI InChI=1S/C26H33N5OS/c1-29-24(21-9-4-3-5-10-21)27-28-25(29)33-18-8-15-30-16-13-26(14-17-30)19-31(20-26)22-11-6-7-12-23(22)32-2/h3-7,9-12H,8,13-20H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	3.76E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D2 long receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50250805 (CHEMBL4076086) Show SMILES Cn1c(SCCCN2CCC3(CC2)CCN(CC3)c2cccc(c2)C#N)nnc1-c1ccccc1 Show InChI InChI=1S/C28H34N6S/c1-32-26(24-8-3-2-4-9-24)30-31-27(32)35-20-6-15-33-16-11-28(12-17-33)13-18-34(19-14-28)25-10-5-7-23(21-25)22-29/h2-5,7-10,21H,6,11-20H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	5.71E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D2 long receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50250811 (CHEMBL4089290) Show SMILES COc1ccccc1N1CCC2(CN(CCCSc3nnc(-c4ccccc4)n3C)C2)C1 Show InChI InChI=1S/C25H31N5OS/c1-28-23(20-9-4-3-5-10-20)26-27-24(28)32-16-8-14-29-17-25(18-29)13-15-30(19-25)21-11-6-7-12-22(21)31-2/h3-7,9-12H,8,13-19H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	6.02E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D2 long receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50250806 (CHEMBL4076527) Show SMILES Cn1c(SCCCN2CCC3(CC2)CCN(CC3)c2ccccn2)nnc1-c1ccccc1 Show InChI InChI=1S/C26H34N6S/c1-30-24(22-8-3-2-4-9-22)28-29-25(30)33-21-7-16-31-17-11-26(12-18-31)13-19-32(20-14-26)23-10-5-6-15-27-23/h2-6,8-10,15H,7,11-14,16-21H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	8.37E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D2 long receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50250809 (CHEMBL4100699) Show SMILES COc1ccc(cc1)N1CCC2(CCN(CCCSc3nnc(-c4ccccc4)n3C)CC2)CC1 Show InChI InChI=1S/C28H37N5OS/c1-31-26(23-7-4-3-5-8-23)29-30-27(31)35-22-6-17-32-18-13-28(14-19-32)15-20-33(21-16-28)24-9-11-25(34-2)12-10-24/h3-5,7-12H,6,13-22H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	1.05E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D2 long receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50250800 (CHEMBL4098399) Show SMILES Cn1c(SCCCN2CC3(CCN3c3ccc(F)cc3)C2)nnc1-c1ccccc1 Show InChI InChI=1S/C23H26FN5S/c1-27-21(18-6-3-2-4-7-18)25-26-22(27)30-15-5-13-28-16-23(17-28)12-14-29(23)20-10-8-19(24)9-11-20/h2-4,6-11H,5,12-17H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	>1.10E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D2 long receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50250801 (CHEMBL4079642) Show SMILES COc1ccccc1N1CCC11CN(CCCSc2nnc(-c3ccccc3)n2C)C1 Show InChI InChI=1S/C24H29N5OS/c1-27-22(19-9-4-3-5-10-19)25-26-23(27)31-16-8-14-28-17-24(18-28)13-15-29(24)20-11-6-7-12-21(20)30-2/h3-7,9-12H,8,13-18H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.15E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D2 long receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50250800 (CHEMBL4098399) Show SMILES Cn1c(SCCCN2CC3(CCN3c3ccc(F)cc3)C2)nnc1-c1ccccc1 Show InChI InChI=1S/C23H26FN5S/c1-27-21(18-6-3-2-4-7-18)25-26-22(27)30-15-5-13-28-16-23(17-28)12-14-29(23)20-10-8-19(24)9-11-20/h2-4,6-11H,5,12-17H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	1.82E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Displacement of [125I]ABN from human dopamine D3 receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting method				J Med Chem 60: 9905-9910 (2017) Article DOI: 10.1021/acs.jmedchem.7b01248 BindingDB Entry DOI: 10.7270/Q21838X7
					More data for this Ligand-Target Pair