Compile Data Set for Download or QSAR

Found 35 hits Enz. Inhib. hit(s) with all data for entry = 50044411   

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))	BDBM50007518 ((S)-3-chloro-5-ethyl-N-((1-ethylpyrrolidin-2-yl)me...) Show SMILES CCN1CCC[C@H]1CNC(=O)c1c(O)c(CC)cc(Cl)c1OC Show InChI InChI=1S/C17H25ClN2O3/c1-4-11-9-13(18)16(23-3)14(15(11)21)17(22)19-10-12-7-6-8-20(12)5-2/h9,12,21H,4-8,10H2,1-3H3,(H,19,22)/t12-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	0.0860	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50004813 (8-[4-(4-Fluoro-phenyl)-4-oxo-butyl]-3-methyl-1-phe...) Show SMILES CN1CN(c2ccccc2)C2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O Show InChI InChI=1S/C24H28FN3O2/c1-26-18-28(21-6-3-2-4-7-21)24(23(26)30)13-16-27(17-14-24)15-5-8-22(29)19-9-11-20(25)12-10-19/h2-4,6-7,9-12H,5,8,13-18H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	0.133	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50007518 ((S)-3-chloro-5-ethyl-N-((1-ethylpyrrolidin-2-yl)me...) Show SMILES CCN1CCC[C@H]1CNC(=O)c1c(O)c(CC)cc(Cl)c1OC Show InChI InChI=1S/C17H25ClN2O3/c1-4-11-9-13(18)16(23-3)14(15(11)21)17(22)19-10-12-7-6-8-20(12)5-2/h9,12,21H,4-8,10H2,1-3H3,(H,19,22)/t12-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	0.134	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50004813 (8-[4-(4-Fluoro-phenyl)-4-oxo-butyl]-3-methyl-1-phe...) Show SMILES CN1CN(c2ccccc2)C2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O Show InChI InChI=1S/C24H28FN3O2/c1-26-18-28(21-6-3-2-4-7-21)24(23(26)30)13-16-27(17-14-24)15-5-8-22(29)19-9-11-20(25)12-10-19/h2-4,6-7,9-12H,5,8,13-18H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	0.265	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50400512 (CHEMBL2203405) Show SMILES CCCN(CC[C@@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)[C@H]1CCc2nc(N)sc2C1 |r,wU:9.11,6.6,wD:24.26,6.5,(37,-43.99,;37,-42.44,;35.67,-41.67,;35.67,-40.13,;37.01,-39.36,;38.34,-40.14,;39.67,-39.37,;39.66,-40.91,;41.16,-39.77,;41.56,-38.29,;40.07,-37.89,;42.9,-37.52,;44.23,-38.3,;44.22,-39.84,;45.59,-37.56,;45.59,-36.03,;46.91,-35.26,;48.23,-36.02,;49.56,-35.25,;50.9,-36.03,;50.89,-37.57,;49.56,-38.33,;48.23,-37.55,;46.92,-38.32,;34.34,-39.36,;34.34,-37.82,;33.01,-37.04,;31.68,-37.81,;30.21,-37.33,;29.3,-38.59,;27.76,-38.59,;30.21,-39.84,;31.68,-39.36,;33.01,-40.12,)| Show InChI InChI=1S/C27H34N4O2S/c1-2-12-31(22-9-10-23-24(15-22)34-26(28)30-23)13-11-27(33)16-21(17-27)29-25(32)20-8-7-18-5-3-4-6-19(18)14-20/h3-8,14,21-22,33H,2,9-13,15-17H2,1H3,(H2,28,30)(H,29,32)/t21-,22-,27+/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]R-(+)-7-OHDPAT from dopamine D3 receptor in Sprague-Dawley rat ventral striatum after 90 mins				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50119380 (CHEMBL25236 | CHEMBL540612 | N-(4-(4-(2-methoxyphe...) Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc3ccccc3c2)CC1 Show InChI InChI=1S/C26H31N3O2/c1-31-25-11-5-4-10-24(25)29-18-16-28(17-19-29)15-7-6-14-27-26(30)23-13-12-21-8-2-3-9-22(21)20-23/h2-5,8-13,20H,6-7,14-19H2,1H3,(H,27,30)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	1.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]R-(+)-7-OHDPAT from dopamine D3 receptor in Sprague-Dawley rat ventral striatum after 90 mins				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM123850 (US8748608, 34 | US8748608, 34 Enantiomer A | US874...) Show SMILES OC(CCNC(=O)c1cc2ccccc2[nH]1)CN1CCN(CC1)c1cccc(Cl)c1Cl Show InChI InChI=1S/C23H26Cl2N4O2/c24-18-5-3-7-21(22(18)25)29-12-10-28(11-13-29)15-17(30)8-9-26-23(31)20-14-16-4-1-2-6-19(16)27-20/h1-7,14,17,27,30H,8-13,15H2,(H,26,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	1.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50366495 ((+)butaclamol | CHEMBL1255588) Show SMILES CC(C)(C)[C@@]1(O)CCN2C[C@@H]3c4ccccc4CCc4cccc([C@H]2C1)c34 |r| Show InChI InChI=1S/C25H31NO/c1-24(2,3)25(27)13-14-26-16-21-19-9-5-4-7-17(19)11-12-18-8-6-10-20(23(18)21)22(26)15-25/h4-10,21-22,27H,11-16H2,1-3H3/t21-,22-,25-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50016453 (CHEMBL3265063) Show SMILES CCCN(CC[C@@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)C1CC1c1ccc(Cl)cc1 |r,wU:9.11,6.6,(11.39,-45.37,;11.38,-43.83,;10.04,-43.06,;10.03,-41.52,;11.36,-40.75,;12.7,-41.51,;14.03,-40.73,;14.42,-42.21,;15.51,-41.13,;15.9,-39.64,;14.41,-39.25,;17.23,-38.86,;18.57,-39.63,;18.58,-41.17,;19.9,-38.85,;19.88,-37.32,;21.21,-36.54,;22.55,-37.3,;23.87,-36.53,;25.21,-37.28,;25.22,-38.83,;23.89,-39.6,;22.56,-38.84,;21.23,-39.62,;8.7,-40.76,;7.92,-39.43,;7.16,-40.77,;5.83,-41.54,;4.49,-40.78,;3.16,-41.55,;3.16,-43.1,;1.83,-43.86,;4.5,-43.87,;5.83,-43.09,)| Show InChI InChI=1S/C29H33ClN2O2/c1-2-14-32(27-17-26(27)21-9-11-24(30)12-10-21)15-13-29(34)18-25(19-29)31-28(33)23-8-7-20-5-3-4-6-22(20)16-23/h3-12,16,25-27,34H,2,13-15,17-19H2,1H3,(H,31,33)/t25-,26?,27?,29+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50016462 (CHEMBL3265067) Show SMILES CCCN(CC[C@@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)[C@@H]1C[C@H]1c1ccc(Cl)cc1 |r,wU:24.26,9.11,6.6,wD:26.30,(25.73,-55.68,;25.72,-54.14,;24.39,-53.38,;24.38,-51.84,;25.71,-51.06,;27.05,-51.83,;28.38,-51.05,;28.77,-52.53,;29.86,-51.45,;30.25,-49.96,;28.76,-49.56,;31.58,-49.18,;32.92,-49.94,;32.92,-51.48,;34.25,-49.17,;34.23,-47.63,;35.55,-46.85,;36.9,-47.62,;38.22,-46.84,;39.55,-47.6,;39.57,-49.14,;38.24,-49.92,;36.9,-49.16,;35.58,-49.94,;23.04,-51.08,;22.26,-49.74,;21.5,-51.09,;20.17,-51.86,;18.84,-51.1,;17.51,-51.87,;17.5,-53.41,;16.17,-54.18,;18.84,-54.18,;20.18,-53.41,)| Show InChI InChI=1S/C29H33ClN2O2/c1-2-14-32(27-17-26(27)21-9-11-24(30)12-10-21)15-13-29(34)18-25(19-29)31-28(33)23-8-7-20-5-3-4-6-22(20)16-23/h3-12,16,25-27,34H,2,13-15,17-19H2,1H3,(H,31,33)/t25-,26-,27+,29+/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]R-(+)-7-OHDPAT from dopamine D3 receptor in Sprague-Dawley rat ventral striatum after 90 mins				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50016462 (CHEMBL3265067) Show SMILES CCCN(CC[C@@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)[C@@H]1C[C@H]1c1ccc(Cl)cc1 |r,wU:24.26,9.11,6.6,wD:26.30,(25.73,-55.68,;25.72,-54.14,;24.39,-53.38,;24.38,-51.84,;25.71,-51.06,;27.05,-51.83,;28.38,-51.05,;28.77,-52.53,;29.86,-51.45,;30.25,-49.96,;28.76,-49.56,;31.58,-49.18,;32.92,-49.94,;32.92,-51.48,;34.25,-49.17,;34.23,-47.63,;35.55,-46.85,;36.9,-47.62,;38.22,-46.84,;39.55,-47.6,;39.57,-49.14,;38.24,-49.92,;36.9,-49.16,;35.58,-49.94,;23.04,-51.08,;22.26,-49.74,;21.5,-51.09,;20.17,-51.86,;18.84,-51.1,;17.51,-51.87,;17.5,-53.41,;16.17,-54.18,;18.84,-54.18,;20.18,-53.41,)| Show InChI InChI=1S/C29H33ClN2O2/c1-2-14-32(27-17-26(27)21-9-11-24(30)12-10-21)15-13-29(34)18-25(19-29)31-28(33)23-8-7-20-5-3-4-6-22(20)16-23/h3-12,16,25-27,34H,2,13-15,17-19H2,1H3,(H,31,33)/t25-,26-,27+,29+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50016453 (CHEMBL3265063) Show SMILES CCCN(CC[C@@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)C1CC1c1ccc(Cl)cc1 |r,wU:9.11,6.6,(11.39,-45.37,;11.38,-43.83,;10.04,-43.06,;10.03,-41.52,;11.36,-40.75,;12.7,-41.51,;14.03,-40.73,;14.42,-42.21,;15.51,-41.13,;15.9,-39.64,;14.41,-39.25,;17.23,-38.86,;18.57,-39.63,;18.58,-41.17,;19.9,-38.85,;19.88,-37.32,;21.21,-36.54,;22.55,-37.3,;23.87,-36.53,;25.21,-37.28,;25.22,-38.83,;23.89,-39.6,;22.56,-38.84,;21.23,-39.62,;8.7,-40.76,;7.92,-39.43,;7.16,-40.77,;5.83,-41.54,;4.49,-40.78,;3.16,-41.55,;3.16,-43.1,;1.83,-43.86,;4.5,-43.87,;5.83,-43.09,)| Show InChI InChI=1S/C29H33ClN2O2/c1-2-14-32(27-17-26(27)21-9-11-24(30)12-10-21)15-13-29(34)18-25(19-29)31-28(33)23-8-7-20-5-3-4-6-22(20)16-23/h3-12,16,25-27,34H,2,13-15,17-19H2,1H3,(H,31,33)/t25-,26?,27?,29+	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]R-(+)-7-OHDPAT from dopamine D3 receptor in Sprague-Dawley rat ventral striatum after 90 mins				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50366495 ((+)butaclamol | CHEMBL1255588) Show SMILES CC(C)(C)[C@@]1(O)CCN2C[C@@H]3c4ccccc4CCc4cccc([C@H]2C1)c34 |r| Show InChI InChI=1S/C25H31NO/c1-24(2,3)25(27)13-14-26-16-21-19-9-5-4-7-17(19)11-12-18-8-6-10-20(23(18)21)22(26)15-25/h4-10,21-22,27H,11-16H2,1-3H3/t21-,22-,25-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50219105 (CHEMBL242644 | N-(3-hydroxy-4-(4-(2-methoxyphenyl)...) Show SMILES COc1ccccc1N1CCN(CC(O)CCNC(=O)c2ccc(cc2)-c2ccccn2)CC1 |w:13.14| Show InChI InChI=1S/C27H32N4O3/c1-34-26-8-3-2-7-25(26)31-18-16-30(17-19-31)20-23(32)13-15-29-27(33)22-11-9-21(10-12-22)24-6-4-5-14-28-24/h2-12,14,23,32H,13,15-20H2,1H3,(H,29,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	6.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50005118 ((S)-3,5-Dichloro-N-(1-ethyl-pyrrolidin-2-ylmethyl)...) Show SMILES CCN1CCC[C@H]1CNC(=O)c1c(O)c(Cl)cc(Cl)c1OC Show InChI InChI=1S/C15H20Cl2N2O3/c1-3-19-6-4-5-9(19)8-18-15(21)12-13(20)10(16)7-11(17)14(12)22-2/h7,9,20H,3-6,8H2,1-2H3,(H,18,21)/t9-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50005118 ((S)-3,5-Dichloro-N-(1-ethyl-pyrrolidin-2-ylmethyl)...) Show SMILES CCN1CCC[C@H]1CNC(=O)c1c(O)c(Cl)cc(Cl)c1OC Show InChI InChI=1S/C15H20Cl2N2O3/c1-3-19-6-4-5-9(19)8-18-15(21)12-13(20)10(16)7-11(17)14(12)22-2/h7,9,20H,3-6,8H2,1-2H3,(H,18,21)/t9-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50016447 (CHEMBL3265064) Show SMILES CCCN(CC[C@@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)[C@H]1C[C@@H]1c1ccccc1Cl |r,wU:26.30,9.11,6.6,wD:24.26,(35.58,-43.79,;35.58,-42.25,;34.24,-41.49,;34.23,-39.95,;35.56,-39.17,;36.9,-39.94,;38.23,-39.16,;38.62,-40.64,;39.71,-39.56,;40.1,-38.07,;38.61,-37.68,;41.43,-37.29,;42.77,-38.05,;42.78,-39.59,;44.1,-37.28,;44.08,-35.75,;45.4,-34.97,;46.75,-35.73,;48.07,-34.96,;49.41,-35.71,;49.42,-37.25,;48.09,-38.03,;46.76,-37.27,;45.43,-38.05,;32.89,-39.19,;32.12,-37.86,;31.36,-39.2,;30.02,-39.97,;28.69,-39.21,;27.36,-39.98,;27.36,-41.52,;28.69,-42.29,;30.03,-41.52,;31.37,-42.29,)| Show InChI InChI=1S/C29H33ClN2O2/c1-2-14-32(27-17-25(27)24-9-5-6-10-26(24)30)15-13-29(34)18-23(19-29)31-28(33)22-12-11-20-7-3-4-8-21(20)16-22/h3-12,16,23,25,27,34H,2,13-15,17-19H2,1H3,(H,31,33)/t23-,25-,27+,29+/m1/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]R-(+)-7-OHDPAT from dopamine D3 receptor in Sprague-Dawley rat ventral striatum after 90 mins				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50016447 (CHEMBL3265064) Show SMILES CCCN(CC[C@@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)[C@H]1C[C@@H]1c1ccccc1Cl |r,wU:26.30,9.11,6.6,wD:24.26,(35.58,-43.79,;35.58,-42.25,;34.24,-41.49,;34.23,-39.95,;35.56,-39.17,;36.9,-39.94,;38.23,-39.16,;38.62,-40.64,;39.71,-39.56,;40.1,-38.07,;38.61,-37.68,;41.43,-37.29,;42.77,-38.05,;42.78,-39.59,;44.1,-37.28,;44.08,-35.75,;45.4,-34.97,;46.75,-35.73,;48.07,-34.96,;49.41,-35.71,;49.42,-37.25,;48.09,-38.03,;46.76,-37.27,;45.43,-38.05,;32.89,-39.19,;32.12,-37.86,;31.36,-39.2,;30.02,-39.97,;28.69,-39.21,;27.36,-39.98,;27.36,-41.52,;28.69,-42.29,;30.03,-41.52,;31.37,-42.29,)| Show InChI InChI=1S/C29H33ClN2O2/c1-2-14-32(27-17-25(27)24-9-5-6-10-26(24)30)15-13-29(34)18-23(19-29)31-28(33)22-12-11-20-7-3-4-8-21(20)16-22/h3-12,16,23,25,27,34H,2,13-15,17-19H2,1H3,(H,31,33)/t23-,25-,27+,29+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50016444 (CHEMBL3265065) Show SMILES CCCN(CC[C@@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)[C@H]1C[C@@H]1c1cccc(Cl)c1 |r,wU:26.30,9.11,6.6,wD:24.26,(60.72,-41.94,;60.71,-40.4,;59.37,-39.63,;59.36,-38.09,;60.69,-37.32,;62.03,-38.08,;63.36,-37.3,;63.75,-38.78,;64.84,-37.7,;65.23,-36.21,;63.74,-35.82,;66.56,-35.43,;67.9,-36.2,;67.91,-37.74,;69.23,-35.42,;69.21,-33.89,;70.54,-33.11,;71.88,-33.87,;73.2,-33.1,;74.54,-33.85,;74.55,-35.4,;73.22,-36.17,;71.89,-35.41,;70.56,-36.19,;58.03,-37.33,;57.25,-36,;56.49,-37.34,;55.16,-38.11,;53.82,-37.35,;52.49,-38.12,;52.49,-39.67,;53.83,-40.44,;53.83,-41.98,;55.16,-39.67,)| Show InChI InChI=1S/C29H33ClN2O2/c1-2-13-32(27-17-26(27)22-8-5-9-24(30)16-22)14-12-29(34)18-25(19-29)31-28(33)23-11-10-20-6-3-4-7-21(20)15-23/h3-11,15-16,25-27,34H,2,12-14,17-19H2,1H3,(H,31,33)/t25-,26-,27+,29+/m1/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	28	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]R-(+)-7-OHDPAT from dopamine D3 receptor in Sprague-Dawley rat ventral striatum after 90 mins				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50016444 (CHEMBL3265065) Show SMILES CCCN(CC[C@@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)[C@H]1C[C@@H]1c1cccc(Cl)c1 |r,wU:26.30,9.11,6.6,wD:24.26,(60.72,-41.94,;60.71,-40.4,;59.37,-39.63,;59.36,-38.09,;60.69,-37.32,;62.03,-38.08,;63.36,-37.3,;63.75,-38.78,;64.84,-37.7,;65.23,-36.21,;63.74,-35.82,;66.56,-35.43,;67.9,-36.2,;67.91,-37.74,;69.23,-35.42,;69.21,-33.89,;70.54,-33.11,;71.88,-33.87,;73.2,-33.1,;74.54,-33.85,;74.55,-35.4,;73.22,-36.17,;71.89,-35.41,;70.56,-36.19,;58.03,-37.33,;57.25,-36,;56.49,-37.34,;55.16,-38.11,;53.82,-37.35,;52.49,-38.12,;52.49,-39.67,;53.83,-40.44,;53.83,-41.98,;55.16,-39.67,)| Show InChI InChI=1S/C29H33ClN2O2/c1-2-13-32(27-17-26(27)22-8-5-9-24(30)16-22)14-12-29(34)18-25(19-29)31-28(33)23-11-10-20-6-3-4-7-21(20)15-23/h3-11,15-16,25-27,34H,2,12-14,17-19H2,1H3,(H,31,33)/t25-,26-,27+,29+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	38	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D3 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50016464 (CHEMBL3265062) Show SMILES CCCN(CC[C@@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)[C@@H]1C[C@H]1c1ccccc1 |r,wU:24.26,9.11,6.6,wD:26.30,(51.38,-31.74,;51.37,-30.2,;50.03,-29.44,;50.02,-27.9,;51.35,-27.12,;52.69,-27.88,;54.02,-27.11,;54.41,-28.59,;55.5,-27.5,;55.89,-26.01,;54.4,-25.62,;57.22,-25.24,;58.56,-26,;58.57,-27.54,;59.89,-25.22,;59.87,-23.69,;61.2,-22.91,;62.54,-23.67,;63.86,-22.9,;65.2,-23.65,;65.21,-25.2,;63.88,-25.98,;62.55,-25.21,;61.22,-25.99,;48.68,-27.13,;47.91,-25.8,;47.15,-27.14,;45.82,-27.92,;44.48,-27.15,;43.15,-27.92,;43.15,-29.47,;44.48,-30.24,;45.82,-29.47,)| Show InChI InChI=1S/C29H34N2O2/c1-2-15-31(27-18-26(27)22-9-4-3-5-10-22)16-14-29(33)19-25(20-29)30-28(32)24-13-12-21-8-6-7-11-23(21)17-24/h3-13,17,25-27,33H,2,14-16,18-20H2,1H3,(H,30,32)/t25-,26-,27+,29+/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	44	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]R-(+)-7-OHDPAT from dopamine D3 receptor in Sprague-Dawley rat ventral striatum after 90 mins				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50312273 ((1R,5S/1S,5R)-1-[2-Fluoro-4-(trifluoromethyl)pheny...) Show SMILES Cc1ncoc1-c1nnc(SCCCN2CC3CC3(C2)c2ccc(cc2F)C(F)(F)F)n1C Show InChI InChI=1S/C22H23F4N5OS/c1-13-18(32-12-27-13)19-28-29-20(30(19)2)33-7-3-6-31-10-15-9-21(15,11-31)16-5-4-14(8-17(16)23)22(24,25)26/h4-5,8,12,15H,3,6-7,9-11H2,1-2H3	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	46	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]R-(+)-7-OHDPAT from dopamine D3 receptor in Sprague-Dawley rat ventral striatum after 90 mins				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50016465 (CHEMBL3265061) Show SMILES CCCN(CC[C@@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)[C@H]1C[C@@H]1c1ccccc1 |r,wU:26.30,9.11,6.6,wD:24.26,(23.51,-32.96,;23.5,-31.42,;22.17,-30.66,;22.16,-29.12,;23.49,-28.34,;24.83,-29.1,;26.16,-28.32,;26.55,-29.8,;27.64,-28.72,;28.03,-27.23,;26.54,-26.84,;29.36,-26.46,;30.7,-27.22,;30.7,-28.76,;32.03,-26.44,;32.01,-24.91,;33.33,-24.13,;34.68,-24.89,;36,-24.12,;37.33,-24.87,;37.35,-26.42,;36.02,-27.19,;34.68,-26.43,;33.36,-27.21,;20.82,-28.35,;20.05,-27.02,;19.28,-28.36,;17.95,-29.14,;16.62,-28.37,;15.29,-29.14,;15.29,-30.69,;16.62,-31.46,;17.96,-30.69,)| Show InChI InChI=1S/C29H34N2O2/c1-2-15-31(27-18-26(27)22-9-4-3-5-10-22)16-14-29(33)19-25(20-29)30-28(32)24-13-12-21-8-6-7-11-23(21)17-24/h3-13,17,25-27,33H,2,14-16,18-20H2,1H3,(H,30,32)/t25-,26-,27+,29+/m1/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	108	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]R-(+)-7-OHDPAT from dopamine D3 receptor in Sprague-Dawley rat ventral striatum after 90 mins				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50016463 (CHEMBL3265066) Show SMILES CCCN(CC[C@@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)[C@H]1C[C@@H]1c1ccc(Cl)cc1 |r,wU:26.30,9.11,6.6,wD:24.26,(11.39,-45.37,;11.38,-43.83,;10.04,-43.06,;10.03,-41.52,;11.36,-40.75,;12.7,-41.51,;14.03,-40.73,;14.42,-42.21,;15.51,-41.13,;15.9,-39.64,;14.41,-39.25,;17.23,-38.86,;18.57,-39.63,;18.58,-41.17,;19.9,-38.85,;19.88,-37.32,;21.21,-36.54,;22.55,-37.3,;23.87,-36.53,;25.21,-37.28,;25.22,-38.83,;23.89,-39.6,;22.56,-38.84,;21.23,-39.62,;8.7,-40.76,;7.92,-39.43,;7.16,-40.77,;5.83,-41.54,;4.49,-40.78,;3.16,-41.55,;3.16,-43.1,;1.83,-43.86,;4.5,-43.87,;5.83,-43.09,)| Show InChI InChI=1S/C29H33ClN2O2/c1-2-14-32(27-17-26(27)21-9-11-24(30)12-10-21)15-13-29(34)18-25(19-29)31-28(33)23-8-7-20-5-3-4-6-22(20)16-23/h3-12,16,25-27,34H,2,13-15,17-19H2,1H3,(H,31,33)/t25-,26-,27+,29+/m1/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	457	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]R-(+)-7-OHDPAT from dopamine D3 receptor in Sprague-Dawley rat ventral striatum after 90 mins				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50016462 (CHEMBL3265067) Show SMILES CCCN(CC[C@@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)[C@@H]1C[C@H]1c1ccc(Cl)cc1 |r,wU:24.26,9.11,6.6,wD:26.30,(25.73,-55.68,;25.72,-54.14,;24.39,-53.38,;24.38,-51.84,;25.71,-51.06,;27.05,-51.83,;28.38,-51.05,;28.77,-52.53,;29.86,-51.45,;30.25,-49.96,;28.76,-49.56,;31.58,-49.18,;32.92,-49.94,;32.92,-51.48,;34.25,-49.17,;34.23,-47.63,;35.55,-46.85,;36.9,-47.62,;38.22,-46.84,;39.55,-47.6,;39.57,-49.14,;38.24,-49.92,;36.9,-49.16,;35.58,-49.94,;23.04,-51.08,;22.26,-49.74,;21.5,-51.09,;20.17,-51.86,;18.84,-51.1,;17.51,-51.87,;17.5,-53.41,;16.17,-54.18,;18.84,-54.18,;20.18,-53.41,)| Show InChI InChI=1S/C29H33ClN2O2/c1-2-14-32(27-17-26(27)21-9-11-24(30)12-10-21)15-13-29(34)18-25(19-29)31-28(33)23-8-7-20-5-3-4-6-22(20)16-23/h3-12,16,25-27,34H,2,13-15,17-19H2,1H3,(H,31,33)/t25-,26-,27+,29+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	623	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50016453 (CHEMBL3265063) Show SMILES CCCN(CC[C@@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)C1CC1c1ccc(Cl)cc1 |r,wU:9.11,6.6,(11.39,-45.37,;11.38,-43.83,;10.04,-43.06,;10.03,-41.52,;11.36,-40.75,;12.7,-41.51,;14.03,-40.73,;14.42,-42.21,;15.51,-41.13,;15.9,-39.64,;14.41,-39.25,;17.23,-38.86,;18.57,-39.63,;18.58,-41.17,;19.9,-38.85,;19.88,-37.32,;21.21,-36.54,;22.55,-37.3,;23.87,-36.53,;25.21,-37.28,;25.22,-38.83,;23.89,-39.6,;22.56,-38.84,;21.23,-39.62,;8.7,-40.76,;7.92,-39.43,;7.16,-40.77,;5.83,-41.54,;4.49,-40.78,;3.16,-41.55,;3.16,-43.1,;1.83,-43.86,;4.5,-43.87,;5.83,-43.09,)| Show InChI InChI=1S/C29H33ClN2O2/c1-2-14-32(27-17-26(27)21-9-11-24(30)12-10-21)15-13-29(34)18-25(19-29)31-28(33)23-8-7-20-5-3-4-6-22(20)16-23/h3-12,16,25-27,34H,2,13-15,17-19H2,1H3,(H,31,33)/t25-,26?,27?,29+	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	667	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM123850 (US8748608, 34 | US8748608, 34 Enantiomer A | US874...) Show SMILES OC(CCNC(=O)c1cc2ccccc2[nH]1)CN1CCN(CC1)c1cccc(Cl)c1Cl Show InChI InChI=1S/C23H26Cl2N4O2/c24-18-5-3-7-21(22(18)25)29-12-10-28(11-13-29)15-17(30)8-9-26-23(31)20-14-16-4-1-2-6-19(16)27-20/h1-7,14,17,27,30H,8-13,15H2,(H,26,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	746	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50016447 (CHEMBL3265064) Show SMILES CCCN(CC[C@@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)[C@H]1C[C@@H]1c1ccccc1Cl |r,wU:26.30,9.11,6.6,wD:24.26,(35.58,-43.79,;35.58,-42.25,;34.24,-41.49,;34.23,-39.95,;35.56,-39.17,;36.9,-39.94,;38.23,-39.16,;38.62,-40.64,;39.71,-39.56,;40.1,-38.07,;38.61,-37.68,;41.43,-37.29,;42.77,-38.05,;42.78,-39.59,;44.1,-37.28,;44.08,-35.75,;45.4,-34.97,;46.75,-35.73,;48.07,-34.96,;49.41,-35.71,;49.42,-37.25,;48.09,-38.03,;46.76,-37.27,;45.43,-38.05,;32.89,-39.19,;32.12,-37.86,;31.36,-39.2,;30.02,-39.97,;28.69,-39.21,;27.36,-39.98,;27.36,-41.52,;28.69,-42.29,;30.03,-41.52,;31.37,-42.29,)| Show InChI InChI=1S/C29H33ClN2O2/c1-2-14-32(27-17-25(27)24-9-5-6-10-26(24)30)15-13-29(34)18-23(19-29)31-28(33)22-12-11-20-7-3-4-8-21(20)16-22/h3-12,16,23,25,27,34H,2,13-15,17-19H2,1H3,(H,31,33)/t23-,25-,27+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	923	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50219105 (CHEMBL242644 | N-(3-hydroxy-4-(4-(2-methoxyphenyl)...) Show SMILES COc1ccccc1N1CCN(CC(O)CCNC(=O)c2ccc(cc2)-c2ccccn2)CC1 |w:13.14| Show InChI InChI=1S/C27H32N4O3/c1-34-26-8-3-2-7-25(26)31-18-16-30(17-19-31)20-23(32)13-15-29-27(33)22-11-9-21(10-12-22)24-6-4-5-14-28-24/h2-12,14,23,32H,13,15-20H2,1H3,(H,29,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.09E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50016467 (CHEMBL3265059) Show SMILES CCCN[C@H]1C[C@@H]1c1ccccc1 |r| Show InChI InChI=1S/C12H17N/c1-2-8-13-12-9-11(12)10-6-4-3-5-7-10/h3-7,11-13H,2,8-9H2,1H3/t11-,12+/m1/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.17E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]R-(+)-7-OHDPAT from dopamine D3 receptor in Sprague-Dawley rat ventral striatum after 90 mins				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50016466 (CHEMBL3265060) Show SMILES CCCN[C@@H]1C[C@H]1c1ccccc1 |r| Show InChI InChI=1S/C12H17N/c1-2-8-13-12-9-11(12)10-6-4-3-5-7-10/h3-7,11-13H,2,8-9H2,1H3/t11-,12+/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]R-(+)-7-OHDPAT from dopamine D3 receptor in Sprague-Dawley rat ventral striatum after 90 mins				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50016444 (CHEMBL3265065) Show SMILES CCCN(CC[C@@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)[C@H]1C[C@@H]1c1cccc(Cl)c1 |r,wU:26.30,9.11,6.6,wD:24.26,(60.72,-41.94,;60.71,-40.4,;59.37,-39.63,;59.36,-38.09,;60.69,-37.32,;62.03,-38.08,;63.36,-37.3,;63.75,-38.78,;64.84,-37.7,;65.23,-36.21,;63.74,-35.82,;66.56,-35.43,;67.9,-36.2,;67.91,-37.74,;69.23,-35.42,;69.21,-33.89,;70.54,-33.11,;71.88,-33.87,;73.2,-33.1,;74.54,-33.85,;74.55,-35.4,;73.22,-36.17,;71.89,-35.41,;70.56,-36.19,;58.03,-37.33,;57.25,-36,;56.49,-37.34,;55.16,-38.11,;53.82,-37.35,;52.49,-38.12,;52.49,-39.67,;53.83,-40.44,;53.83,-41.98,;55.16,-39.67,)| Show InChI InChI=1S/C29H33ClN2O2/c1-2-13-32(27-17-26(27)22-8-5-9-24(30)16-22)14-12-29(34)18-25(19-29)31-28(33)23-11-10-20-6-3-4-7-21(20)15-23/h3-11,15-16,25-27,34H,2,12-14,17-19H2,1H3,(H,31,33)/t25-,26-,27+,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.22E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D2 receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting analysis				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50240772 ((1R,2S)-(-)-2-phenylcyclopropylamine | (1R,2S)-2-p...) Show SMILES N[C@@H]1C[C@H]1c1ccccc1 |r| Show InChI InChI=1S/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/t8-,9+/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	1.28E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]R-(+)-7-OHDPAT from dopamine D3 receptor in Sprague-Dawley rat ventral striatum after 90 mins				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50119380 (CHEMBL25236 | CHEMBL540612 | N-(4-(4-(2-methoxyphe...) Show SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc3ccccc3c2)CC1 Show InChI InChI=1S/C26H31N3O2/c1-31-25-11-5-4-10-24(25)29-18-16-28(17-19-29)15-7-6-14-27-26(30)23-13-12-21-8-2-3-9-22(21)20-23/h2-5,8-13,20H,6-7,14-19H2,1H3,(H,27,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D3 receptor expressed in human U2OS cells assessed as inhibition of pramipexole-stimulated beta-arrestin recrui...				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50016462 (CHEMBL3265067) Show SMILES CCCN(CC[C@@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)[C@@H]1C[C@H]1c1ccc(Cl)cc1 |r,wU:24.26,9.11,6.6,wD:26.30,(25.73,-55.68,;25.72,-54.14,;24.39,-53.38,;24.38,-51.84,;25.71,-51.06,;27.05,-51.83,;28.38,-51.05,;28.77,-52.53,;29.86,-51.45,;30.25,-49.96,;28.76,-49.56,;31.58,-49.18,;32.92,-49.94,;32.92,-51.48,;34.25,-49.17,;34.23,-47.63,;35.55,-46.85,;36.9,-47.62,;38.22,-46.84,;39.55,-47.6,;39.57,-49.14,;38.24,-49.92,;36.9,-49.16,;35.58,-49.94,;23.04,-51.08,;22.26,-49.74,;21.5,-51.09,;20.17,-51.86,;18.84,-51.1,;17.51,-51.87,;17.5,-53.41,;16.17,-54.18,;18.84,-54.18,;20.18,-53.41,)| Show InChI InChI=1S/C29H33ClN2O2/c1-2-14-32(27-17-26(27)21-9-11-24(30)12-10-21)15-13-29(34)18-25(19-29)31-28(33)23-8-7-20-5-3-4-6-22(20)16-23/h3-12,16,25-27,34H,2,13-15,17-19H2,1H3,(H,31,33)/t25-,26-,27+,29+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	327	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D3 receptor expressed in human U2OS cells assessed as inhibition of pramipexole-stimulated beta-arrestin recrui...				J Med Chem 57: 4962-8 (2014) Article DOI: 10.1021/jm401798r BindingDB Entry DOI: 10.7270/Q2BV7J5V
					More data for this Ligand-Target Pair