Compile Data Set for Download or QSAR

Found 159 hits with Last Name = 'coldwell' and Initial = 'mc'   

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(3) dopamine receptor (Homo sapiens (Human))	BDBM50132022 (Biphenyl-4-carboxylic acid [4-((4aS,10bS)-7-hydrox...) Show SMILES Oc1cccc2[C@@H]3CCCN(CCCCNC(=O)c4ccc(cc4)-c4ccccc4)[C@H]3CCc12 Show InChI InChI=1S/C30H34N2O2/c33-29-12-6-10-25-26-11-7-21-32(28(26)18-17-27(25)29)20-5-4-19-31-30(34)24-15-13-23(14-16-24)22-8-2-1-3-9-22/h1-3,6,8-10,12-16,26,28,33H,4-5,7,11,17-21H2,(H,31,34)/t26-,28-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity at Dopamine receptor D3 expressed in CHO cells by [125I]iodosulpiride displacement.				Bioorg Med Chem Lett 8: 2859-64 (1998) BindingDB Entry DOI: 10.7270/Q2319Z1B
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50000022 (CHEMBL57219) Show SMILES CCCN(CCCCNC(=O)c1ccc(cc1)-c1ccccc1)C1CCc2c(C1)cccc2OS(=O)(=O)C(F)(F)F Show InChI InChI=1S/C31H35F3N2O4S/c1-2-20-36(27-17-18-28-26(22-27)11-8-12-29(28)40-41(38,39)31(32,33)34)21-7-6-19-35-30(37)25-15-13-24(14-16-25)23-9-4-3-5-10-23/h3-5,8-16,27H,2,6-7,17-22H2,1H3,(H,35,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50000027 (CHEMBL51977) Show SMILES CCCN(CCCCNC(=O)c1ccc(cc1)-c1ccccc1)C1CCc2c(Cl)cccc2C1 Show InChI InChI=1S/C30H35ClN2O/c1-2-20-33(27-17-18-28-26(22-27)11-8-12-29(28)31)21-7-6-19-32-30(34)25-15-13-24(14-16-25)23-9-4-3-5-10-23/h3-5,8-16,27H,2,6-7,17-22H2,1H3,(H,32,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50216344 (CHEMBL319116) Show SMILES [H][C@]12CCc3c(O)cccc3[C@]1([H])CCN2CCCCNC(=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C29H32N2O2/c32-28-10-6-9-24-25-17-20-31(27(25)16-15-26(24)28)19-5-4-18-30-29(33)23-13-11-22(12-14-23)21-7-2-1-3-8-21/h1-3,6-14,25,27,32H,4-5,15-20H2,(H,30,33)/t25-,27-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity at Dopamine receptor D3 expressed in CHO cells by [125I]iodosulpiride displacement.				Bioorg Med Chem Lett 8: 2859-64 (1998) BindingDB Entry DOI: 10.7270/Q2319Z1B
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217155 (CHEMBL291545) Show SMILES FC(F)(F)S(=O)(=O)Oc1ccc2CCN(CCCCNC(=O)\C=C\c3ccc4[nH]ccc4c3)Cc2c1 Show InChI InChI=1S/C25H26F3N3O4S/c26-25(27,28)36(33,34)35-22-6-5-19-10-14-31(17-21(19)16-22)13-2-1-11-30-24(32)8-4-18-3-7-23-20(15-18)9-12-29-23/h3-9,12,15-16,29H,1-2,10-11,13-14,17H2,(H,30,32)/b8-4+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217169 (CHEMBL279925) Show SMILES Cc1nnc(o1)-c1ccc(cc1)-c1ccc(cc1)C(=O)NCCCCN1CCc2ccc(OS(=O)(=O)C(F)(F)F)cc2C1 Show InChI InChI=1S/C30H29F3N4O5S/c1-20-35-36-29(41-20)25-10-6-22(7-11-25)21-4-8-24(9-5-21)28(38)34-15-2-3-16-37-17-14-23-12-13-27(18-26(23)19-37)42-43(39,40)30(31,32)33/h4-13,18H,2-3,14-17,19H2,1H3,(H,34,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217172 (CHEMBL52724) Show SMILES CNC(=O)c1cccc(c1)-c1ccc(cc1)C(=O)NCCCCN1CCc2ccc(OS(=O)(=O)C(F)(F)F)cc2C1 Show InChI InChI=1S/C29H30F3N3O5S/c1-33-27(36)24-6-4-5-23(17-24)20-7-9-22(10-8-20)28(37)34-14-2-3-15-35-16-13-21-11-12-26(18-25(21)19-35)40-41(38,39)29(30,31)32/h4-12,17-18H,2-3,13-16,19H2,1H3,(H,33,36)(H,34,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217176 (CHEMBL297960) Show SMILES FC(F)(F)S(=O)(=O)Oc1ccc2CCN(CCCCNC(=O)c3ccc(cc3)-c3ccc(cc3)N3CCCC3=O)Cc2c1 Show InChI InChI=1S/C31H32F3N3O5S/c32-31(33,34)43(40,41)42-28-14-11-24-15-19-36(21-26(24)20-28)17-2-1-16-35-30(39)25-7-5-22(6-8-25)23-9-12-27(13-10-23)37-18-3-4-29(37)38/h5-14,20H,1-4,15-19,21H2,(H,35,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217171 (CHEMBL54777) Show SMILES CNC(=O)c1ccc(cc1)-c1ccc(cc1)C(=O)NCCCCN1CCc2ccc(OS(=O)(=O)C(F)(F)F)cc2C1 Show InChI InChI=1S/C29H30F3N3O5S/c1-33-27(36)23-8-4-20(5-9-23)21-6-10-24(11-7-21)28(37)34-15-2-3-16-35-17-14-22-12-13-26(18-25(22)19-35)40-41(38,39)29(30,31)32/h4-13,18H,2-3,14-17,19H2,1H3,(H,33,36)(H,34,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217156 (CHEMBL52466) Show SMILES Oc1ccc2cc(\C=C\C(=O)NCCCCN3CCc4ccc(OS(=O)(=O)C(F)(F)F)cc4C3)ccc2n1 Show InChI InChI=1S/C26H26F3N3O5S/c27-26(28,29)38(35,36)37-22-7-5-19-11-14-32(17-21(19)16-22)13-2-1-12-30-24(33)9-4-18-3-8-23-20(15-18)6-10-25(34)31-23/h3-10,15-16H,1-2,11-14,17H2,(H,30,33)(H,31,34)/b9-4+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217165 (CHEMBL367129) Show SMILES CC(=O)c1ccc(cc1)-c1ccc(cc1)C(=O)NCCCCN1CCc2ccc(OS(=O)(=O)C(F)(F)F)cc2C1 Show InChI InChI=1S/C29H29F3N2O5S/c1-20(35)21-4-6-22(7-5-21)23-8-10-25(11-9-23)28(36)33-15-2-3-16-34-17-14-24-12-13-27(18-26(24)19-34)39-40(37,38)29(30,31)32/h4-13,18H,2-3,14-17,19H2,1H3,(H,33,36)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217164 (CHEMBL416842) Show SMILES COc1cccc(\C=C\C(=O)NCCCCN2CCc3ccc(OS(=O)(=O)C(F)(F)F)cc3C2)c1 Show InChI InChI=1S/C24H27F3N2O5S/c1-33-21-6-4-5-18(15-21)7-10-23(30)28-12-2-3-13-29-14-11-19-8-9-22(16-20(19)17-29)34-35(31,32)24(25,26)27/h4-10,15-16H,2-3,11-14,17H2,1H3,(H,28,30)/b10-7+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217160 (CHEMBL52468) Show SMILES FC(F)(F)S(=O)(=O)Oc1ccc2CCN(CCCCNC(=O)\C=C\c3ccc4ncccc4c3)Cc2c1 Show InChI InChI=1S/C26H26F3N3O4S/c27-26(28,29)37(34,35)36-23-8-7-20-11-15-32(18-22(20)17-23)14-2-1-12-31-25(33)10-6-19-5-9-24-21(16-19)4-3-13-30-24/h3-10,13,16-17H,1-2,11-12,14-15,18H2,(H,31,33)/b10-6+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217161 (CHEMBL52135) Show SMILES CC(=O)c1cccc(\C=C\C(=O)NCCCCN2CCc3ccc(OS(=O)(=O)C(F)(F)F)cc3C2)c1 Show InChI InChI=1S/C25H27F3N2O5S/c1-18(31)21-6-4-5-19(15-21)7-10-24(32)29-12-2-3-13-30-14-11-20-8-9-23(16-22(20)17-30)35-36(33,34)25(26,27)28/h4-10,15-16H,2-3,11-14,17H2,1H3,(H,29,32)/b10-7+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217154 (CHEMBL293347) Show SMILES CC(=O)c1ccc(\C=C\C(=O)NCCCCN2CCc3ccc(OS(=O)(=O)C(F)(F)F)cc3C2)cc1 Show InChI InChI=1S/C25H27F3N2O5S/c1-18(31)20-7-4-19(5-8-20)6-11-24(32)29-13-2-3-14-30-15-12-21-9-10-23(16-22(21)17-30)35-36(33,34)25(26,27)28/h4-11,16H,2-3,12-15,17H2,1H3,(H,29,32)/b11-6+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217168 (CHEMBL301475) Show SMILES FC(F)(F)S(=O)(=O)Oc1ccc2CCN(CCCCNC(=O)\C=C\c3c[nH]c4ccccc34)Cc2c1 Show InChI InChI=1S/C25H26F3N3O4S/c26-25(27,28)36(33,34)35-21-9-7-18-11-14-31(17-20(18)15-21)13-4-3-12-29-24(32)10-8-19-16-30-23-6-2-1-5-22(19)23/h1-2,5-10,15-16,30H,3-4,11-14,17H2,(H,29,32)/b10-8+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217173 (CHEMBL55090) Show SMILES FC(F)(F)S(=O)(=O)Oc1ccc2CCN(CCCCNC(=O)\C=C\c3ccc4ccccc4n3)Cc2c1 Show InChI InChI=1S/C26H26F3N3O4S/c27-26(28,29)37(34,35)36-23-11-8-19-13-16-32(18-21(19)17-23)15-4-3-14-30-25(33)12-10-22-9-7-20-5-1-2-6-24(20)31-22/h1-2,5-12,17H,3-4,13-16,18H2,(H,30,33)/b12-10+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217163 (CHEMBL52987) Show SMILES COc1ccc(\C=C\C(=O)NCCCCN2CCc3ccc(OS(=O)(=O)C(F)(F)F)cc3C2)cc1 Show InChI InChI=1S/C24H27F3N2O5S/c1-33-21-8-4-18(5-9-21)6-11-23(30)28-13-2-3-14-29-15-12-19-7-10-22(16-20(19)17-29)34-35(31,32)24(25,26)27/h4-11,16H,2-3,12-15,17H2,1H3,(H,28,30)/b11-6+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217175 (CHEMBL53351) Show SMILES CN(C)c1ccc(\C=C\C(=O)NCCCCN2CCc3ccc(OS(=O)(=O)C(F)(F)F)cc3C2)cc1 Show InChI InChI=1S/C25H30F3N3O4S/c1-30(2)22-9-5-19(6-10-22)7-12-24(32)29-14-3-4-15-31-16-13-20-8-11-23(17-21(20)18-31)35-36(33,34)25(26,27)28/h5-12,17H,3-4,13-16,18H2,1-2H3,(H,29,32)/b12-7+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50470855 (CHEMBL60708) Show SMILES COc1cc2ccccc2cc1C(=O)NC1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C23H24N2O2/c1-27-22-14-19-10-6-5-9-18(19)13-21(22)23(26)24-20-11-12-25(16-20)15-17-7-3-2-4-8-17/h2-10,13-14,20H,11-12,15-16H2,1H3,(H,24,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Ltd Curated by ChEMBL					Assay Description Binding affinity against cloned human Dopamine receptor D4 using [3H]nemonapride as radioligand				J Med Chem 39: 1946-8 (1996) Article DOI: 10.1021/jm960017l BindingDB Entry DOI: 10.7270/Q2R49THW
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217166 (CHEMBL52901) Show SMILES FC(F)(F)S(=O)(=O)Oc1ccc2CCN(CCCCNC(=O)\C=C\c3cnc4ccccc4c3)Cc2c1 Show InChI InChI=1S/C26H26F3N3O4S/c27-26(28,29)37(34,35)36-23-9-8-20-11-14-32(18-22(20)16-23)13-4-3-12-30-25(33)10-7-19-15-21-5-1-2-6-24(21)31-17-19/h1-2,5-10,15-17H,3-4,11-14,18H2,(H,30,33)/b10-7+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217158 (CHEMBL55840) Show SMILES FC(F)(F)S(=O)(=O)Oc1ccc2CCN(CCCCNC(=O)\C=C\c3ccc4ccccc4c3)Cc2c1 Show InChI InChI=1S/C27H27F3N2O4S/c28-27(29,30)37(34,35)36-25-11-10-22-13-16-32(19-24(22)18-25)15-4-3-14-31-26(33)12-8-20-7-9-21-5-1-2-6-23(21)17-20/h1-2,5-12,17-18H,3-4,13-16,19H2,(H,31,33)/b12-8+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50216340 (CHEMBL99876) Show SMILES [H][C@]12CCc3c(OS(C)(=O)=O)cccc3[C@]1([H])CCN2CCCCNC(=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C30H34N2O4S/c1-37(34,35)36-29-11-7-10-25-26-18-21-32(28(26)17-16-27(25)29)20-6-5-19-31-30(33)24-14-12-23(13-15-24)22-8-3-2-4-9-22/h2-4,7-15,26,28H,5-6,16-21H2,1H3,(H,31,33)/t26-,28-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity at Dopamine receptor D3 expressed in CHO cells by [125I]iodosulpiride displacement.				Bioorg Med Chem Lett 8: 2859-64 (1998) BindingDB Entry DOI: 10.7270/Q2319Z1B
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50470850 (CHEMBL59326) Show SMILES COc1cc2ccccc2cc1C(=O)OCC1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C25H27NO3/c1-28-24-16-22-10-6-5-9-21(22)15-23(24)25(27)29-18-20-11-13-26(14-12-20)17-19-7-3-2-4-8-19/h2-10,15-16,20H,11-14,17-18H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Ltd Curated by ChEMBL					Assay Description Binding affinity against cloned human Dopamine receptor D4 using [3H]nemonapride as radioligand				J Med Chem 39: 1946-8 (1996) Article DOI: 10.1021/jm960017l BindingDB Entry DOI: 10.7270/Q2R49THW
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217174 (CHEMBL55276) Show SMILES FC(F)(F)S(=O)(=O)Oc1ccc2CCN(CCCCNC(=O)\C=C\c3ccccc3)Cc2c1 Show InChI InChI=1S/C23H25F3N2O4S/c24-23(25,26)33(30,31)32-21-10-9-19-12-15-28(17-20(19)16-21)14-5-4-13-27-22(29)11-8-18-6-2-1-3-7-18/h1-3,6-11,16H,4-5,12-15,17H2,(H,27,29)/b11-8+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50470854 (CHEMBL433255) Show SMILES COc1cc2ccccc2cc1OC(=O)CC1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C25H27NO3/c1-28-23-16-21-9-5-6-10-22(21)17-24(23)29-25(27)15-19-11-13-26(14-12-19)18-20-7-3-2-4-8-20/h2-10,16-17,19H,11-15,18H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	6.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Ltd Curated by ChEMBL					Assay Description Binding affinity against cloned human Dopamine receptor D4 using [3H]nemonapride as radioligand				J Med Chem 39: 1946-8 (1996) Article DOI: 10.1021/jm960017l BindingDB Entry DOI: 10.7270/Q2R49THW
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50216355 (CHEMBL318925) Show SMILES [H][C@]12CCc3c(OS(C)(=O)=O)cccc3[C@]1([H])CCCN2CCCCNC(=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C31H36N2O4S/c1-38(35,36)37-30-13-7-11-26-27-12-8-22-33(29(27)19-18-28(26)30)21-6-5-20-32-31(34)25-16-14-24(15-17-25)23-9-3-2-4-10-23/h2-4,7,9-11,13-17,27,29H,5-6,8,12,18-22H2,1H3,(H,32,34)/t27-,29-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	6.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity at Dopamine receptor D3 expressed in CHO cells by [125I]iodosulpiride displacement.				Bioorg Med Chem Lett 8: 2859-64 (1998) BindingDB Entry DOI: 10.7270/Q2319Z1B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50003359 (5-(4-Hexyloxy-[1,2,5]thiadiazol-3-yl)-1-methyl-1,2...) Show SMILES CCCCCCOc1nsnc1C1=CCCN(C)C1 |t:13| Show InChI InChI=1S/C14H23N3OS/c1-3-4-5-6-10-18-14-13(15-19-16-14)12-8-7-9-17(2)11-12/h8H,3-7,9-11H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	6.31	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by PDSP Ki Database									Br J Pharmacol 125: 1413-20 (1998) Article DOI: 10.1038/sj.bjp.0702201 BindingDB Entry DOI: 10.7270/Q2HM56ZD
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50216339 (CHEMBL2111591) Show SMILES [H][C@]12CCc3c(OC)cccc3[C@]1([H])CCCN2CCCCNC(=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C31H36N2O2/c1-35-30-13-7-11-26-27-12-8-22-33(29(27)19-18-28(26)30)21-6-5-20-32-31(34)25-16-14-24(15-17-25)23-9-3-2-4-10-23/h2-4,7,9-11,13-17,27,29H,5-6,8,12,18-22H2,1H3,(H,32,34)/t27-,29-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	7.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity at Dopamine receptor D3 expressed in CHO cells by [125I]iodosulpiride displacement.				Bioorg Med Chem Lett 8: 2859-64 (1998) BindingDB Entry DOI: 10.7270/Q2319Z1B
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50216348 (CHEMBL95759) Show SMILES [H][C@]12CCc3cc(O)ccc3[C@]1([H])CCCN2CCCCNC(=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C30H34N2O2/c33-26-15-16-27-25(21-26)14-17-29-28(27)9-6-20-32(29)19-5-4-18-31-30(34)24-12-10-23(11-13-24)22-7-2-1-3-8-22/h1-3,7-8,10-13,15-16,21,28-29,33H,4-6,9,14,17-20H2,(H,31,34)/t28-,29-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	7.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity at Dopamine receptor D3 expressed in CHO cells by [125I]iodosulpiride displacement.				Bioorg Med Chem Lett 8: 2859-64 (1998) BindingDB Entry DOI: 10.7270/Q2319Z1B
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217170 (CHEMBL299038) Show SMILES FC(F)(F)S(=O)(=O)Oc1ccc2CCN(CCCCNC(=O)c3ccc(cc3)-c3ccccc3)Cc2c1 Show InChI InChI=1S/C27H27F3N2O4S/c28-27(29,30)37(34,35)36-25-13-12-22-14-17-32(19-24(22)18-25)16-5-4-15-31-26(33)23-10-8-21(9-11-23)20-6-2-1-3-7-20/h1-3,6-13,18H,4-5,14-17,19H2,(H,31,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	7.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217177 (CHEMBL292577) Show SMILES Cn1c2ccc(\C=C\C(=O)NCCCCN3CCc4ccc(OS(=O)(=O)C(F)(F)F)cc4C3)cc2ccc1=O Show InChI InChI=1S/C27H28F3N3O5S/c1-32-24-9-4-19(16-21(24)7-11-26(32)35)5-10-25(34)31-13-2-3-14-33-15-12-20-6-8-23(17-22(20)18-33)38-39(36,37)27(28,29)30/h4-11,16-17H,2-3,12-15,18H2,1H3,(H,31,34)/b10-5+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50216351 (CHEMBL2111592) Show SMILES CS(=O)(=O)Oc1cccc2C3CCCN(CCCCNC(=O)c4ccc(cc4)-c4ccccc4)C3CCc12 Show InChI InChI=1S/C31H36N2O4S/c1-38(35,36)37-30-13-7-11-26-27-12-8-22-33(29(27)19-18-28(26)30)21-6-5-20-32-31(34)25-16-14-24(15-17-25)23-9-3-2-4-10-23/h2-4,7,9-11,13-17,27,29H,5-6,8,12,18-22H2,1H3,(H,32,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity at Dopamine receptor D3 expressed in CHO cells by [125I]iodosulpiride displacement.				Bioorg Med Chem Lett 8: 2859-64 (1998) BindingDB Entry DOI: 10.7270/Q2319Z1B
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50167898 (CHEMBL85606 | N-((1r,4r)-4-(2-(6-cyano-3,4-dihydro...) Show SMILES O=C(NC1CC[C@H](CCN2CCc3cc(ccc3C2)C#N)CC1)c1ccnc2ccccc12 |wD:6.6,(-3.87,-1.76,;-3.86,-3.3,;-2.52,-4.08,;-1.18,-3.3,;-1.19,-1.76,;.15,-.99,;1.48,-1.76,;2.83,-.99,;4.16,-1.76,;5.49,-.99,;5.49,.54,;6.84,1.31,;8.17,.53,;9.5,1.3,;10.83,.53,;10.81,-1.01,;9.48,-1.78,;8.16,-1.01,;6.84,-1.78,;12.17,1.29,;13.5,2.07,;1.48,-3.3,;.15,-4.08,;-5.19,-4.09,;-5.19,-5.64,;-6.54,-6.41,;-7.87,-5.64,;-7.87,-4.09,;-9.19,-3.33,;-9.2,-1.81,;-7.87,-1.03,;-6.54,-1.78,;-6.54,-3.33,)| Show InChI InChI=1S/C28H30N4O/c29-18-21-5-8-23-19-32(16-13-22(23)17-21)15-12-20-6-9-24(10-7-20)31-28(33)26-11-14-30-27-4-2-1-3-25(26)27/h1-5,8,11,14,17,20,24H,6-7,9-10,12-13,15-16,19H2,(H,31,33)/t20-,24?	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	10.7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by PDSP Ki Database									J Pharmacol Exp Ther 294: 1154-65 (2000) BindingDB Entry DOI: 10.7270/Q2K35S7G
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50167898 (CHEMBL85606 | N-((1r,4r)-4-(2-(6-cyano-3,4-dihydro...) Show SMILES O=C(NC1CC[C@H](CCN2CCc3cc(ccc3C2)C#N)CC1)c1ccnc2ccccc12 |wD:6.6,(-3.87,-1.76,;-3.86,-3.3,;-2.52,-4.08,;-1.18,-3.3,;-1.19,-1.76,;.15,-.99,;1.48,-1.76,;2.83,-.99,;4.16,-1.76,;5.49,-.99,;5.49,.54,;6.84,1.31,;8.17,.53,;9.5,1.3,;10.83,.53,;10.81,-1.01,;9.48,-1.78,;8.16,-1.01,;6.84,-1.78,;12.17,1.29,;13.5,2.07,;1.48,-3.3,;.15,-4.08,;-5.19,-4.09,;-5.19,-5.64,;-6.54,-6.41,;-7.87,-5.64,;-7.87,-4.09,;-9.19,-3.33,;-9.2,-1.81,;-7.87,-1.03,;-6.54,-1.78,;-6.54,-3.33,)| Show InChI InChI=1S/C28H30N4O/c29-18-21-5-8-23-19-32(16-13-22(23)17-21)15-12-20-6-9-24(10-7-20)31-28(33)26-11-14-30-27-4-2-1-3-25(26)27/h1-5,8,11,14,17,20,24H,6-7,9-10,12-13,15-16,19H2,(H,31,33)/t20-,24?	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	11.2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by PDSP Ki Database									J Pharmacol Exp Ther 294: 1154-65 (2000) BindingDB Entry DOI: 10.7270/Q2K35S7G
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50216360 (CHEMBL97856) Show SMILES [H][C@]12CCc3cc(O)ccc3[C@]1([H])CCN2CCCCNC(=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C29H32N2O2/c32-25-13-14-26-24(20-25)12-15-28-27(26)16-19-31(28)18-5-4-17-30-29(33)23-10-8-22(9-11-23)21-6-2-1-3-7-21/h1-3,6-11,13-14,20,27-28,32H,4-5,12,15-19H2,(H,30,33)/t27-,28-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity at Dopamine receptor D3 expressed in CHO cells by [125I]iodosulpiride displacement.				Bioorg Med Chem Lett 8: 2859-64 (1998) BindingDB Entry DOI: 10.7270/Q2319Z1B
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50216353 (CHEMBL98452) Show SMILES [H][C@]12CCc3ccccc3[C@]1([H])CCN2CCCCNC(=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C29H32N2O/c32-29(25-14-12-23(13-15-25)22-8-2-1-3-9-22)30-19-6-7-20-31-21-18-27-26-11-5-4-10-24(26)16-17-28(27)31/h1-5,8-15,27-28H,6-7,16-21H2,(H,30,32)/t27-,28-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity at Dopamine receptor D3 expressed in CHO cells by [125I]iodosulpiride displacement.				Bioorg Med Chem Lett 8: 2859-64 (1998) BindingDB Entry DOI: 10.7270/Q2319Z1B
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50216346 (CHEMBL95743) Show SMILES [H][C@@]12CCc3ccccc3[C@@]1([H])CCCN2CCCCNC(=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C30H34N2O/c33-30(26-16-14-24(15-17-26)23-9-2-1-3-10-23)31-20-6-7-21-32-22-8-13-28-27-12-5-4-11-25(27)18-19-29(28)32/h1-5,9-12,14-17,28-29H,6-8,13,18-22H2,(H,31,33)/t28-,29-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity at Dopamine receptor D3 expressed in CHO cells by [125I]iodosulpiride displacement.				Bioorg Med Chem Lett 8: 2859-64 (1998) BindingDB Entry DOI: 10.7270/Q2319Z1B
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50216350 (CHEMBL97118) Show SMILES [H][C@]12CCc3c(OC)cccc3[C@]1([H])CCN2CCCCNC(=O)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C30H34N2O2/c1-34-29-11-7-10-25-26-18-21-32(28(26)17-16-27(25)29)20-6-5-19-31-30(33)24-14-12-23(13-15-24)22-8-3-2-4-9-22/h2-4,7-15,26,28H,5-6,16-21H2,1H3,(H,31,33)/t26-,28-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity at Dopamine receptor D3 expressed in CHO cells by [125I]iodosulpiride displacement.				Bioorg Med Chem Lett 8: 2859-64 (1998) BindingDB Entry DOI: 10.7270/Q2319Z1B
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M4 (Homo sapiens (Human))	BDBM50003359 (5-(4-Hexyloxy-[1,2,5]thiadiazol-3-yl)-1-methyl-1,2...) Show SMILES CCCCCCOc1nsnc1C1=CCCN(C)C1 |t:13| Show InChI InChI=1S/C14H23N3OS/c1-3-4-5-6-10-18-14-13(15-19-16-14)12-8-7-9-17(2)11-12/h8H,3-7,9-11H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	19.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by PDSP Ki Database									Br J Pharmacol 125: 1413-20 (1998) Article DOI: 10.1038/sj.bjp.0702201 BindingDB Entry DOI: 10.7270/Q2HM56ZD
					More data for this Ligand-Target Pair				3D Structure (crystal)
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50003359 (5-(4-Hexyloxy-[1,2,5]thiadiazol-3-yl)-1-methyl-1,2...) Show SMILES CCCCCCOc1nsnc1C1=CCCN(C)C1 |t:13| Show InChI InChI=1S/C14H23N3OS/c1-3-4-5-6-10-18-14-13(15-19-16-14)12-8-7-9-17(2)11-12/h8H,3-7,9-11H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	19.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by PDSP Ki Database									Br J Pharmacol 125: 1413-20 (1998) Article DOI: 10.1038/sj.bjp.0702201 BindingDB Entry DOI: 10.7270/Q2HM56ZD
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50470852 (CHEMBL57019) Show SMILES COc1cc2ccccc2cc1C(=O)OCC1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C24H25NO3/c1-27-23-14-21-10-6-5-9-20(21)13-22(23)24(26)28-17-19-11-12-25(16-19)15-18-7-3-2-4-8-18/h2-10,13-14,19H,11-12,15-17H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Ltd Curated by ChEMBL					Assay Description Binding affinity against cloned human Dopamine receptor D4 using [3H]nemonapride as radioligand				J Med Chem 39: 1946-8 (1996) Article DOI: 10.1021/jm960017l BindingDB Entry DOI: 10.7270/Q2R49THW
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50203469 (3-Methoxy-naphthalene-2-carboxylic acid (1-benzyl-...) Show SMILES COc1cc2ccccc2cc1C(=O)NCC1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C25H28N2O2/c1-29-24-16-22-10-6-5-9-21(22)15-23(24)25(28)26-17-19-11-13-27(14-12-19)18-20-7-3-2-4-8-20/h2-10,15-16,19H,11-14,17-18H2,1H3,(H,26,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL 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
SmithKline Beecham Pharmaceuticals Ltd Curated by ChEMBL					Assay Description Binding affinity against cloned human Dopamine receptor D4 using [3H]nemonapride as radioligand				J Med Chem 39: 1946-8 (1996) Article DOI: 10.1021/jm960017l BindingDB Entry DOI: 10.7270/Q2R49THW
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50470857 (CHEMBL299479) Show SMILES Clc1ccc(cc1)C(=O)OCC1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C20H22ClNO2/c21-19-8-6-18(7-9-19)20(23)24-15-17-10-12-22(13-11-17)14-16-4-2-1-3-5-16/h1-9,17H,10-15H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Ltd Curated by ChEMBL					Assay Description Binding affinity against cloned human Dopamine receptor D4 using [3H]nemonapride as radioligand				J Med Chem 39: 1946-8 (1996) Article DOI: 10.1021/jm960017l BindingDB Entry DOI: 10.7270/Q2R49THW
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50217153 (CHEMBL53833) Show SMILES O=C(NCCCCN1CCc2ccccc2C1)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C26H28N2O/c29-26(24-14-12-23(13-15-24)21-8-2-1-3-9-21)27-17-6-7-18-28-19-16-22-10-4-5-11-25(22)20-28/h1-5,8-15H,6-7,16-20H2,(H,27,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Displacement of [125I]iodosulpiride from human Dopamine receptor D3 expressed in CHO cells				Bioorg Med Chem Lett 9: 179-84 (1999) BindingDB Entry DOI: 10.7270/Q2057J4D
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50132022 (Biphenyl-4-carboxylic acid [4-((4aS,10bS)-7-hydrox...) Show SMILES Oc1cccc2[C@@H]3CCCN(CCCCNC(=O)c4ccc(cc4)-c4ccccc4)[C@H]3CCc12 Show InChI InChI=1S/C30H34N2O2/c33-29-12-6-10-25-26-11-7-21-32(28(26)18-17-27(25)29)20-5-4-19-31-30(34)24-15-13-23(14-16-24)22-8-2-1-3-9-22/h1-3,6,8-10,12-16,26,28,33H,4-5,7,11,17-21H2,(H,31,34)/t26-,28-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity at Dopamine receptor D2 expressed in CHO cells by [125I]iodosulpiride displacement.				Bioorg Med Chem Lett 8: 2859-64 (1998) BindingDB Entry DOI: 10.7270/Q2319Z1B
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50470849 (CHEMBL59075) Show SMILES COc1cc2ccccc2cc1OCCC1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C25H29NO2/c1-27-24-17-22-9-5-6-10-23(22)18-25(24)28-16-13-20-11-14-26(15-12-20)19-21-7-3-2-4-8-21/h2-10,17-18,20H,11-16,19H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Ltd Curated by ChEMBL					Assay Description Binding affinity against cloned human Dopamine receptor D4 using [3H]nemonapride as radioligand				J Med Chem 39: 1946-8 (1996) Article DOI: 10.1021/jm960017l BindingDB Entry DOI: 10.7270/Q2R49THW
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50470856 (CHEMBL292186) Show SMILES COc1cc2ccccc2cc1C(=O)CCC1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C26H29NO2/c1-29-26-18-23-10-6-5-9-22(23)17-24(26)25(28)12-11-20-13-15-27(16-14-20)19-21-7-3-2-4-8-21/h2-10,17-18,20H,11-16,19H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	32	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Ltd Curated by ChEMBL					Assay Description Binding affinity against cloned human Dopamine receptor D4 using [3H]nemonapride as radioligand				J Med Chem 39: 1946-8 (1996) Article DOI: 10.1021/jm960017l BindingDB Entry DOI: 10.7270/Q2R49THW
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50470851 (CHEMBL57407) Show SMILES COc1cc2ccccc2cc1COCC1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C25H29NO2/c1-27-25-16-23-10-6-5-9-22(23)15-24(25)19-28-18-21-11-13-26(14-12-21)17-20-7-3-2-4-8-20/h2-10,15-16,21H,11-14,17-19H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	32	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Ltd Curated by ChEMBL					Assay Description Binding affinity against cloned human Dopamine receptor D4 using [3H]nemonapride as radioligand				J Med Chem 39: 1946-8 (1996) Article DOI: 10.1021/jm960017l BindingDB Entry DOI: 10.7270/Q2R49THW
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50003359 (5-(4-Hexyloxy-[1,2,5]thiadiazol-3-yl)-1-methyl-1,2...) Show SMILES CCCCCCOc1nsnc1C1=CCCN(C)C1 |t:13| Show InChI InChI=1S/C14H23N3OS/c1-3-4-5-6-10-18-14-13(15-19-16-14)12-8-7-9-17(2)11-12/h8H,3-7,9-11H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	39.8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by PDSP Ki Database									Br J Pharmacol 125: 1413-20 (1998) Article DOI: 10.1038/sj.bjp.0702201 BindingDB Entry DOI: 10.7270/Q2HM56ZD
					More data for this Ligand-Target Pair

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