Compile Data Set for Download or QSAR

Found 539 hits with Last Name = 'radaelli' and Initial = 's'   

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
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208047 (1-methyl-3-(2-oxo-4,4-diphenyl-imidazolidin-1-yl)-...) Show SMILES C[N+]1(CCc2ccccc2)CCC(C1)N1CC(NC1=O)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C28H31N3O/c1-31(19-17-23-11-5-2-6-12-23)20-18-26(21-31)30-22-28(29-27(30)32,24-13-7-3-8-14-24)25-15-9-4-10-16-25/h2-16,26H,17-22H2,1H3/p+1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.670	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208057 (1-methyl-3-(2-oxo-4,4-diphenyl-imidazolidin-1-yl)-...) Show SMILES C[N+]1(CCCc2ccccc2)CCC(C1)N1CC(NC1=O)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C29H33N3O/c1-32(20-11-14-24-12-5-2-6-13-24)21-19-27(22-32)31-23-29(30-28(31)33,25-15-7-3-8-16-25)26-17-9-4-10-18-26/h2-10,12-13,15-18,27H,11,14,19-23H2,1H3/p+1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	0.700	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50208057 (1-methyl-3-(2-oxo-4,4-diphenyl-imidazolidin-1-yl)-...) Show SMILES C[N+]1(CCCc2ccccc2)CCC(C1)N1CC(NC1=O)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C29H33N3O/c1-32(20-11-14-24-12-5-2-6-13-24)21-19-27(22-32)31-23-29(30-28(31)33,25-15-7-3-8-16-25)26-17-9-4-10-18-26/h2-10,12-13,15-18,27H,11,14,19-23H2,1H3/p+1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	0.730	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M2 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208043 (1-methyl-3-(R)-[4,4-Bis-(4-fluoro-phenyl)-2-oxo-im...) Show SMILES C[N+]1(CCc2ccccc2)CC[C@H](C1)N1CC(NC1=O)(c1ccc(F)cc1)c1ccc(F)cc1 Show InChI InChI=1S/C28H29F2N3O/c1-33(17-15-21-5-3-2-4-6-21)18-16-26(19-33)32-20-28(31-27(32)34,22-7-11-24(29)12-8-22)23-9-13-25(30)14-10-23/h2-14,26H,15-20H2,1H3/p+1/t26-,33?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	0.75	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50411716 (CHEMBL429132) Show SMILES Cc1ccc2c(cccc2n1)-c1nnc(SCCCN2CCc3cc4nc(oc4cc3CC2)C(C)(C)C)n1C Show InChI InChI=1S/C31H36N6OS/c1-20-10-11-23-24(8-6-9-25(23)32-20)28-34-35-30(36(28)5)39-17-7-14-37-15-12-21-18-26-27(19-22(21)13-16-37)38-29(33-26)31(2,3)4/h6,8-11,18-19H,7,12-17H2,1-5H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.794	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D3 receptor by cell based GTPgammaS binding assay				Bioorg Med Chem Lett 18: 901-7 (2008) Article DOI: 10.1016/j.bmcl.2007.12.066 BindingDB Entry DOI: 10.7270/Q2MK6F32
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50207996 (3-(1-benzyl-azepin-4-yl)-5,5-diphenyl-imidazolidin...) Show SMILES O=C1NC(CN1C1CCCN(Cc2ccccc2)CC1)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C28H31N3O/c32-27-29-28(24-13-6-2-7-14-24,25-15-8-3-9-16-25)22-31(27)26-17-10-19-30(20-18-26)21-23-11-4-1-5-12-23/h1-9,11-16,26H,10,17-22H2,(H,29,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	0.960	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHO K1 cells				J Med Chem 50: 1571-83 (2007) Article DOI: 10.1021/jm061159a BindingDB Entry DOI: 10.7270/Q2QV3M61
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50411713 (CHEMBL255620) Show SMILES CN(C)c1nc2cc3CCN(CCCSc4nnc(-c5cccc6nc(C)ccc56)n4C)CCc3cc2o1 Show InChI InChI=1S/C29H33N7OS/c1-19-9-10-22-23(7-5-8-24(22)30-19)27-32-33-29(35(27)4)38-16-6-13-36-14-11-20-17-25-26(18-21(20)12-15-36)37-28(31-25)34(2)3/h5,7-10,17-18H,6,11-16H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D3 receptor by cell based GTPgammaS binding assay				Bioorg Med Chem Lett 18: 901-7 (2008) Article DOI: 10.1016/j.bmcl.2007.12.066 BindingDB Entry DOI: 10.7270/Q2MK6F32
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208044 (1-methyl-3-(R)-(2-oxo-4,4-diphenyl-imidazolidin-1-...) Show SMILES C[N+]1(CCOc2ccccc2)CC[C@H](C1)N1CC(NC1=O)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C28H31N3O2/c1-31(19-20-33-26-15-9-4-10-16-26)18-17-25(21-31)30-22-28(29-27(30)32,23-11-5-2-6-12-23)24-13-7-3-8-14-24/h2-16,25H,17-22H2,1H3/p+1/t25-,31?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.04	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50411678 (CHEMBL273199) Show SMILES Cc1cc(-c2ccc3CCN(CCCSc4nnc(-c5cccc6cnc(C)cc56)n4C)CCc3c2)n(C)n1 Show InChI InChI=1S/C31H35N7S/c1-21-17-28-26(20-32-21)7-5-8-27(28)30-33-34-31(36(30)3)39-16-6-13-38-14-11-23-9-10-25(19-24(23)12-15-38)29-18-22(2)35-37(29)4/h5,7-10,17-20H,6,11-16H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.58	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D3 receptor by cell based GTPgammaS binding assay				Bioorg Med Chem Lett 18: 901-7 (2008) Article DOI: 10.1016/j.bmcl.2007.12.066 BindingDB Entry DOI: 10.7270/Q2MK6F32
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208035 (1-methyl-3-(R)-3-[4,4-bis-(4-fluoro-phenyl)-2-oxo-...) Show SMILES C[N+]1(CC(=O)c2ccsc2)CC[C@H](C1)N1CC(NC1=O)(c1ccc(F)cc1)c1ccc(F)cc1 Show InChI InChI=1S/C26H25F2N3O2S/c1-31(15-24(32)18-11-13-34-16-18)12-10-23(14-31)30-17-26(29-25(30)33,19-2-6-21(27)7-3-19)20-4-8-22(28)9-5-20/h2-9,11,13,16,23H,10,12,14-15,17H2,1H3/p+1/t23-,31?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.62	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50208038 (1-methyl-3-(2-oxo-4,4-diphenyl-imidazolidin-1-yl)-...) Show SMILES C[N+]1(CCOc2ccccc2)CCC(C1)N1CC(NC1=O)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C28H31N3O2/c1-31(19-20-33-26-15-9-4-10-16-26)18-17-25(21-31)30-22-28(29-27(30)32,23-11-5-2-6-12-23)24-13-7-3-8-14-24/h2-16,25H,17-22H2,1H3/p+1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.66	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M2 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208018 (3-(1-(3-methylbenzyl)-piperidin-4-yl)-5,5-di-(2-th...) Show SMILES Cc1cccc(CN2CCC(CC2)N2CC(NC2=O)(c2cccs2)c2cccs2)c1 Show InChI InChI=1S/C24H27N3OS2/c1-18-5-2-6-19(15-18)16-26-11-9-20(10-12-26)27-17-24(25-23(27)28,21-7-3-13-29-21)22-8-4-14-30-22/h2-8,13-15,20H,9-12,16-17H2,1H3,(H,25,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.72	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHO K1 cells				J Med Chem 50: 1571-83 (2007) Article DOI: 10.1021/jm061159a BindingDB Entry DOI: 10.7270/Q2QV3M61
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208056 (1-methyl-3-(2-oxo-4,4-diphenyl-imidazolidin-1-yl)-...) Show SMILES C[N+]1(CCCOc2ccccc2)CCC(C1)N1CC(NC1=O)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C29H33N3O2/c1-32(19-11-21-34-27-16-9-4-10-17-27)20-18-26(22-32)31-23-29(30-28(31)33,24-12-5-2-6-13-24)25-14-7-3-8-15-25/h2-10,12-17,26H,11,18-23H2,1H3/p+1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.76	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208051 (1-methyl-3-(R)-3-[4,4-bis-(4-fluoro-phenyl)-2-oxo-...) Show SMILES C[N+]1(CC(=O)c2ccccc2)CC[C@H](C1)N1CC(NC1=O)(c1ccc(F)cc1)c1ccc(F)cc1 Show InChI InChI=1S/C28H27F2N3O2/c1-33(18-26(34)20-5-3-2-4-6-20)16-15-25(17-33)32-19-28(31-27(32)35,21-7-11-23(29)12-8-21)22-9-13-24(30)14-10-22/h2-14,25H,15-19H2,1H3/p+1/t25-,33?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.84	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208058 (1-methyl-3-(2-oxo-4,4-diphenyl-imidazolidin-1-yl)-...) Show SMILES C[N+]1(CC(=O)c2ccccc2)CCC(C1)N1CC(NC1=O)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C28H29N3O2/c1-31(20-26(32)22-11-5-2-6-12-22)18-17-25(19-31)30-21-28(29-27(30)33,23-13-7-3-8-14-23)24-15-9-4-10-16-24/h2-16,25H,17-21H2,1H3/p+1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.89	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208038 (1-methyl-3-(2-oxo-4,4-diphenyl-imidazolidin-1-yl)-...) Show SMILES C[N+]1(CCOc2ccccc2)CCC(C1)N1CC(NC1=O)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C28H31N3O2/c1-31(19-20-33-26-15-9-4-10-16-26)18-17-25(21-31)30-22-28(29-27(30)32,23-11-5-2-6-12-23)24-13-7-3-8-14-24/h2-16,25H,17-22H2,1H3/p+1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.89	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208015 (3-(1-benzylpiperidin-4-yl)-5,5-diphenyl-imidazolid...) Show SMILES O=C1NC(CN1C1CCN(Cc2ccccc2)CC1)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C27H29N3O/c31-26-28-27(23-12-6-2-7-13-23,24-14-8-3-9-15-24)21-30(26)25-16-18-29(19-17-25)20-22-10-4-1-5-11-22/h1-15,25H,16-21H2,(H,28,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHO K1 cells				J Med Chem 50: 1571-83 (2007) Article DOI: 10.1021/jm061159a BindingDB Entry DOI: 10.7270/Q2QV3M61
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50207996 (3-(1-benzyl-azepin-4-yl)-5,5-diphenyl-imidazolidin...) Show SMILES O=C1NC(CN1C1CCCN(Cc2ccccc2)CC1)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C28H31N3O/c32-27-29-28(24-13-6-2-7-14-24,25-15-8-3-9-16-25)22-31(27)26-17-10-19-30(20-18-26)21-23-11-4-1-5-12-23/h1-9,11-16,26H,10,17-22H2,(H,29,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M2 receptor expressed in CHO K1 cells				J Med Chem 50: 1571-83 (2007) Article DOI: 10.1021/jm061159a BindingDB Entry DOI: 10.7270/Q2QV3M61
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208003 (3-(1-(3-methylbenzyl)-piperidin-4-yl)-5,5-diphenyl...) Show SMILES Cc1cccc(CN2CCC(CC2)N2CC(NC2=O)(c2ccccc2)c2ccccc2)c1 Show InChI InChI=1S/C28H31N3O/c1-22-9-8-10-23(19-22)20-30-17-15-26(16-18-30)31-21-28(29-27(31)32,24-11-4-2-5-12-24)25-13-6-3-7-14-25/h2-14,19,26H,15-18,20-21H2,1H3,(H,29,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.37	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHO K1 cells				J Med Chem 50: 1571-83 (2007) Article DOI: 10.1021/jm061159a BindingDB Entry DOI: 10.7270/Q2QV3M61
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50208044 (1-methyl-3-(R)-(2-oxo-4,4-diphenyl-imidazolidin-1-...) Show SMILES C[N+]1(CCOc2ccccc2)CC[C@H](C1)N1CC(NC1=O)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C28H31N3O2/c1-31(19-20-33-26-15-9-4-10-16-26)18-17-25(21-31)30-22-28(29-27(30)32,23-11-5-2-6-12-23)24-13-7-3-8-14-24/h2-16,25H,17-22H2,1H3/p+1/t25-,31?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2.39	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M2 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50411672 (CHEMBL256477) Show SMILES CCc1nn(C)c2cc3CCN(CCCSc4nnc(-c5cccc6nc(C)ccc56)n4C)CCc3cc12 Show InChI InChI=1S/C30H35N7S/c1-5-26-25-18-21-12-15-37(16-13-22(21)19-28(25)36(4)34-26)14-7-17-38-30-33-32-29(35(30)3)24-8-6-9-27-23(24)11-10-20(2)31-27/h6,8-11,18-19H,5,7,12-17H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	2.51	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D3 receptor by cell based GTPgammaS binding assay				Bioorg Med Chem Lett 18: 901-7 (2008) Article DOI: 10.1016/j.bmcl.2007.12.066 BindingDB Entry DOI: 10.7270/Q2MK6F32
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50411669 (CHEMBL271631) Show SMILES CCc1nc2cc3CCN(CCCSc4nnc(-c5cccc6nc(C)ccc56)n4C)CCc3cc2s1 Show InChI InChI=1S/C29H32N6S2/c1-4-27-31-25-17-20-11-14-35(15-12-21(20)18-26(25)37-27)13-6-16-36-29-33-32-28(34(29)3)23-7-5-8-24-22(23)10-9-19(2)30-24/h5,7-10,17-18H,4,6,11-16H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.51	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D3 receptor by cell based GTPgammaS binding assay				Bioorg Med Chem Lett 18: 901-7 (2008) Article DOI: 10.1016/j.bmcl.2007.12.066 BindingDB Entry DOI: 10.7270/Q2MK6F32
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208002 (3-(1-benzyl-piperidin-4-yl)-5-phenyl-5-cyclohexyl-...) Show SMILES O=C1NC(CN1C1CCN(Cc2ccccc2)CC1)(C1CCCCC1)c1ccccc1 Show InChI InChI=1S/C27H35N3O/c31-26-28-27(23-12-6-2-7-13-23,24-14-8-3-9-15-24)21-30(26)25-16-18-29(19-17-25)20-22-10-4-1-5-11-22/h1-2,4-7,10-13,24-25H,3,8-9,14-21H2,(H,28,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.57	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHO K1 cells				J Med Chem 50: 1571-83 (2007) Article DOI: 10.1021/jm061159a BindingDB Entry DOI: 10.7270/Q2QV3M61
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208041 (1-methyl-3-(R)-3-[4,4-bis-(4-fluoro-phenyl)-2-oxo-...) Show SMILES C[N+]1(CC(=O)c2ccccn2)CC[C@H](C1)N1CC(NC1=O)(c1ccc(F)cc1)c1ccc(F)cc1 Show InChI InChI=1S/C27H26F2N4O2/c1-33(17-25(34)24-4-2-3-14-30-24)15-13-23(16-33)32-18-27(31-26(32)35,19-5-9-21(28)10-6-19)20-7-11-22(29)12-8-20/h2-12,14,23H,13,15-18H2,1H3/p+1/t23-,33?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	2.61	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208024 (3-(1-benzyl-piperidin-4-yl)-5,5-di-(2-thienyl)-imi...) Show SMILES O=C1NC(CN1C1CCN(Cc2ccccc2)CC1)(c1cccs1)c1cccs1 Show InChI InChI=1S/C23H25N3OS2/c27-22-24-23(20-8-4-14-28-20,21-9-5-15-29-21)17-26(22)19-10-12-25(13-11-19)16-18-6-2-1-3-7-18/h1-9,14-15,19H,10-13,16-17H2,(H,24,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia 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
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHO K1 cells				J Med Chem 50: 1571-83 (2007) Article DOI: 10.1021/jm061159a BindingDB Entry DOI: 10.7270/Q2QV3M61
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50207990 (3-(1-(3-fluorobenzyl)-piperidin-4-yl)-5,5-di-(2-th...) Show SMILES Fc1cccc(CN2CCC(CC2)N2CC(NC2=O)(c2cccs2)c2cccs2)c1 Show InChI InChI=1S/C23H24FN3OS2/c24-18-5-1-4-17(14-18)15-26-10-8-19(9-11-26)27-16-23(25-22(27)28,20-6-2-12-29-20)21-7-3-13-30-21/h1-7,12-14,19H,8-11,15-16H2,(H,25,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2.75	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHO K1 cells				J Med Chem 50: 1571-83 (2007) Article DOI: 10.1021/jm061159a BindingDB Entry DOI: 10.7270/Q2QV3M61
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208001 (3-(1-benzyl-piperidin-4-yl)-5,5-di-(4-fluorophenyl...) Show SMILES Fc1ccc(cc1)C1(CN(C2CCN(Cc3ccccc3)CC2)C(=O)N1)c1ccc(F)cc1 Show InChI InChI=1S/C27H27F2N3O/c28-23-10-6-21(7-11-23)27(22-8-12-24(29)13-9-22)19-32(26(33)30-27)25-14-16-31(17-15-25)18-20-4-2-1-3-5-20/h1-13,25H,14-19H2,(H,30,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank 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
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHO K1 cells				J Med Chem 50: 1571-83 (2007) Article DOI: 10.1021/jm061159a BindingDB Entry DOI: 10.7270/Q2QV3M61
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208029 (1-methyl-3-(R)-3-[4,4-bis-(4-fluoro-phenyl)-2-oxo-...) Show SMILES C[N+]1(CC(=O)c2cccc(F)c2)CC[C@H](C1)N1CC(NC1=O)(c1ccc(F)cc1)c1ccc(F)cc1 Show InChI InChI=1S/C28H26F3N3O2/c1-34(17-26(35)19-3-2-4-24(31)15-19)14-13-25(16-34)33-18-28(32-27(33)36,20-5-9-22(29)10-6-20)21-7-11-23(30)12-8-21/h2-12,15,25H,13-14,16-18H2,1H3/p+1/t25-,34?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	3.01	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50207987 (3-(1-(3-chlorobenzyl)-piperidin-4-yl)-5,5-diphenyl...) Show SMILES Clc1cccc(CN2CCC(CC2)N2CC(NC2=O)(c2ccccc2)c2ccccc2)c1 Show InChI InChI=1S/C27H28ClN3O/c28-24-13-7-8-21(18-24)19-30-16-14-25(15-17-30)31-20-27(29-26(31)32,22-9-3-1-4-10-22)23-11-5-2-6-12-23/h1-13,18,25H,14-17,19-20H2,(H,29,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHO K1 cells				J Med Chem 50: 1571-83 (2007) Article DOI: 10.1021/jm061159a BindingDB Entry DOI: 10.7270/Q2QV3M61
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50411712 (CHEMBL271083) Show SMILES Cc1ncoc1-c1nnc(SCCCN2CCc3cc4nc(oc4cc3CC2)C(F)(F)C(F)(F)F)n1C Show InChI InChI=1S/C23H23F5N6O2S/c1-13-18(35-12-29-13)19-31-32-21(33(19)2)37-9-3-6-34-7-4-14-10-16-17(11-15(14)5-8-34)36-20(30-16)22(24,25)23(26,27)28/h10-12H,3-9H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D3 receptor by cell based GTPgammaS binding assay				Bioorg Med Chem Lett 18: 901-7 (2008) Article DOI: 10.1016/j.bmcl.2007.12.066 BindingDB Entry DOI: 10.7270/Q2MK6F32
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50411702 (CHEMBL256015) Show SMILES CC(C)c1nc2cc3CCN(CCCSc4nnc(-c5cccc6nc(C)ccc56)n4C)CCc3cc2o1 Show InChI InChI=1S/C30H34N6OS/c1-19(2)29-32-26-17-21-11-14-36(15-12-22(21)18-27(26)37-29)13-6-16-38-30-34-33-28(35(30)4)24-7-5-8-25-23(24)10-9-20(3)31-25/h5,7-10,17-19H,6,11-16H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D3 receptor by cell based GTPgammaS binding assay				Bioorg Med Chem Lett 18: 901-7 (2008) Article DOI: 10.1016/j.bmcl.2007.12.066 BindingDB Entry DOI: 10.7270/Q2MK6F32
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50411703 (CHEMBL402826) Show SMILES CCCc1nc2cc3CCN(CCCSc4nnc(-c5cccc6nc(C)ccc56)n4C)CCc3cc2o1 Show InChI InChI=1S/C30H34N6OS/c1-4-7-28-32-26-18-21-12-15-36(16-13-22(21)19-27(26)37-28)14-6-17-38-30-34-33-29(35(30)3)24-8-5-9-25-23(24)11-10-20(2)31-25/h5,8-11,18-19H,4,6-7,12-17H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.98	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D3 receptor by cell based GTPgammaS binding assay				Bioorg Med Chem Lett 18: 901-7 (2008) Article DOI: 10.1016/j.bmcl.2007.12.066 BindingDB Entry DOI: 10.7270/Q2MK6F32
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50411692 (CHEMBL401728) Show SMILES Cc1cc(-c2nc3cc4CCN(CCCSc5nnc(-c6ocnc6C)n5C)CCc4cc3o2)n(C)n1 Show InChI InChI=1S/C26H30N8O2S/c1-16-12-21(33(4)31-16)25-28-20-13-18-6-9-34(10-7-19(18)14-22(20)36-25)8-5-11-37-26-30-29-24(32(26)3)23-17(2)27-15-35-23/h12-15H,5-11H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.98	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D3 receptor by cell based GTPgammaS binding assay				Bioorg Med Chem Lett 18: 901-7 (2008) Article DOI: 10.1016/j.bmcl.2007.12.066 BindingDB Entry DOI: 10.7270/Q2MK6F32
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50411668 (CHEMBL255567) Show SMILES CCc1nc2cc3CCN(CCCSc4nnc(-c5ocnc5C)n4C)CCc3cc2s1 Show InChI InChI=1S/C23H28N6OS2/c1-4-20-25-18-12-16-6-9-29(10-7-17(16)13-19(18)32-20)8-5-11-31-23-27-26-22(28(23)3)21-15(2)24-14-30-21/h12-14H,4-11H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.98	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D3 receptor by cell based GTPgammaS binding assay				Bioorg Med Chem Lett 18: 901-7 (2008) Article DOI: 10.1016/j.bmcl.2007.12.066 BindingDB Entry DOI: 10.7270/Q2MK6F32
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50370572 (CHEMBL85606 | SB-277011) Show SMILES O=C(N[C@H]1CC[C@H](CCN2CCc3cc(ccc3C2)C#N)CC1)c1ccnc2ccccc12 |r,wU:3.2,wD:6.6,(-5.17,2.38,;-5.16,.84,;-3.83,.08,;-2.49,.85,;-2.5,2.39,;-1.16,3.16,;.18,2.39,;1.51,3.16,;2.84,2.39,;4.18,3.16,;4.17,4.69,;5.51,5.46,;6.84,4.68,;8.18,5.44,;9.51,4.67,;9.5,3.12,;8.16,2.36,;6.83,3.14,;5.51,2.38,;10.85,5.43,;12.18,6.19,;.17,.85,;-1.15,.08,;-6.49,.07,;-7.83,.83,;-9.16,.06,;-9.16,-1.48,;-7.83,-2.25,;-7.83,-3.79,;-6.49,-4.56,;-5.15,-3.79,;-5.16,-2.25,;-6.49,-1.48,)| 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 MCE PC cid PC sid UniChem Similars	Article PubMed	3.98	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D3 receptor by cell based GTPgammaS binding assay				Bioorg Med Chem Lett 18: 901-7 (2008) Article DOI: 10.1016/j.bmcl.2007.12.066 BindingDB Entry DOI: 10.7270/Q2MK6F32
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208014 (3-(1-benzyl-tropin-4-yl)-5,5-diphenyl-imidazolidin...) Show SMILES O=C1NC(CN1C1CC2CCC(C1)N2Cc1ccccc1)(c1ccccc1)c1ccccc1 |TLB:5:6:13:9.10| Show InChI InChI=1S/C29H31N3O/c33-28-30-29(23-12-6-2-7-13-23,24-14-8-3-9-15-24)21-32(28)27-18-25-16-17-26(19-27)31(25)20-22-10-4-1-5-11-22/h1-15,25-27H,16-21H2,(H,30,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	4.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHO K1 cells				J Med Chem 50: 1571-83 (2007) Article DOI: 10.1021/jm061159a BindingDB Entry DOI: 10.7270/Q2QV3M61
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208004 (3-(1-(3-fluorobenzyl)-piperidin-4-yl)-5,5-diphenyl...) Show SMILES Fc1cccc(CN2CCC(CC2)N2CC(NC2=O)(c2ccccc2)c2ccccc2)c1 Show InChI InChI=1S/C27H28FN3O/c28-24-13-7-8-21(18-24)19-30-16-14-25(15-17-30)31-20-27(29-26(31)32,22-9-3-1-4-10-22)23-11-5-2-6-12-23/h1-13,18,25H,14-17,19-20H2,(H,29,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.32	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHO K1 cells				J Med Chem 50: 1571-83 (2007) Article DOI: 10.1021/jm061159a BindingDB Entry DOI: 10.7270/Q2QV3M61
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50207998 (3-(1-(3-methylbenzyl)-piperidin-4-yl)-5-phenyl-5-c...) Show SMILES Cc1cccc(CN2CCC(CC2)N2CC(NC2=O)(C2CCCCC2)c2ccccc2)c1 Show InChI InChI=1S/C28H37N3O/c1-22-9-8-10-23(19-22)20-30-17-15-26(16-18-30)31-21-28(29-27(31)32,24-11-4-2-5-12-24)25-13-6-3-7-14-25/h2,4-5,8-12,19,25-26H,3,6-7,13-18,20-21H2,1H3,(H,29,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	4.54	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHO K1 cells				J Med Chem 50: 1571-83 (2007) Article DOI: 10.1021/jm061159a BindingDB Entry DOI: 10.7270/Q2QV3M61
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208006 (3-(1-(3-fluorobenzyl)-piperidin-4-yl)-5,5-di-(4-fl...) Show SMILES Fc1ccc(cc1)C1(CN(C2CCN(Cc3cccc(F)c3)CC2)C(=O)N1)c1ccc(F)cc1 Show InChI InChI=1S/C27H26F3N3O/c28-22-8-4-20(5-9-22)27(21-6-10-23(29)11-7-21)18-33(26(34)31-27)25-12-14-32(15-13-25)17-19-2-1-3-24(30)16-19/h1-11,16,25H,12-15,17-18H2,(H,31,34)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	4.83	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHO K1 cells				J Med Chem 50: 1571-83 (2007) Article DOI: 10.1021/jm061159a BindingDB Entry DOI: 10.7270/Q2QV3M61
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50411706 (CHEMBL255826) Show SMILES Cc1ccc2c(cccc2n1)-c1nnc(SCCCN2CCc3cc4nc(oc4cc3CC2)N2CCCCC2)n1C Show InChI InChI=1S/C32H37N7OS/c1-22-10-11-25-26(8-6-9-27(25)33-22)30-35-36-32(37(30)2)41-19-7-14-38-17-12-23-20-28-29(21-24(23)13-18-38)40-31(34-28)39-15-4-3-5-16-39/h6,8-11,20-21H,3-5,7,12-19H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.01	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D3 receptor by cell based GTPgammaS binding assay				Bioorg Med Chem Lett 18: 901-7 (2008) Article DOI: 10.1016/j.bmcl.2007.12.066 BindingDB Entry DOI: 10.7270/Q2MK6F32
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50411705 (CHEMBL270227) Show SMILES Cc1ccc2c(cccc2n1)-c1nnc(SCCCN2CCc3cc4nc(oc4cc3CC2)C(F)(F)C(F)(F)F)n1C Show InChI InChI=1S/C29H27F5N6OS/c1-17-7-8-20-21(5-3-6-22(20)35-17)25-37-38-27(39(25)2)42-14-4-11-40-12-9-18-15-23-24(16-19(18)10-13-40)41-26(36-23)28(30,31)29(32,33)34/h3,5-8,15-16H,4,9-14H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.01	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D3 receptor by cell based GTPgammaS binding assay				Bioorg Med Chem Lett 18: 901-7 (2008) Article DOI: 10.1016/j.bmcl.2007.12.066 BindingDB Entry DOI: 10.7270/Q2MK6F32
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50208047 (1-methyl-3-(2-oxo-4,4-diphenyl-imidazolidin-1-yl)-...) Show SMILES C[N+]1(CCc2ccccc2)CCC(C1)N1CC(NC1=O)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C28H31N3O/c1-31(19-17-23-11-5-2-6-12-23)20-18-26(21-31)30-22-28(29-27(30)32,24-13-7-3-8-14-24)25-15-9-4-10-16-25/h2-16,26H,17-22H2,1H3/p+1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M2 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50411660 (CHEMBL256481) Show SMILES Cc1nc2cc3CCN(CCCCSc4nnc(-c5cccc6nc(C)ccc56)n4C)CCc3c(C)c2o1 Show InChI InChI=1S/C30H34N6OS/c1-19-10-11-24-25(8-7-9-26(24)31-19)29-33-34-30(35(29)4)38-17-6-5-14-36-15-12-22-18-27-28(37-21(3)32-27)20(2)23(22)13-16-36/h7-11,18H,5-6,12-17H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.31	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D3 receptor by cell based GTPgammaS binding assay				Bioorg Med Chem Lett 18: 901-7 (2008) Article DOI: 10.1016/j.bmcl.2007.12.066 BindingDB Entry DOI: 10.7270/Q2MK6F32
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50411696 (CHEMBL256473) Show SMILES Cc1ccc2c(cccc2n1)-c1nnc(SCCCN2CCc3cc4nc(oc4cc3CC2)C(C)(F)F)n1C Show InChI InChI=1S/C29H30F2N6OS/c1-18-8-9-21-22(6-4-7-23(21)32-18)26-34-35-28(36(26)3)39-15-5-12-37-13-10-19-16-24-25(17-20(19)11-14-37)38-27(33-24)29(2,30)31/h4,6-9,16-17H,5,10-15H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.31	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human dopamine D3 receptor by cell based GTPgammaS binding assay				Bioorg Med Chem Lett 18: 901-7 (2008) Article DOI: 10.1016/j.bmcl.2007.12.066 BindingDB Entry DOI: 10.7270/Q2MK6F32
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50207999 (3-(1-(3-chlorobenzyl)-piperidin-4-yl)-5-phenyl-5-c...) Show SMILES Clc1cccc(CN2CCC(CC2)N2CC(NC2=O)(C2CCCCC2)c2ccccc2)c1 Show InChI InChI=1S/C27H34ClN3O/c28-24-13-7-8-21(18-24)19-30-16-14-25(15-17-30)31-20-27(29-26(31)32,22-9-3-1-4-10-22)23-11-5-2-6-12-23/h1,3-4,7-10,13,18,23,25H,2,5-6,11-12,14-17,19-20H2,(H,29,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	6.59	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHO K1 cells				J Med Chem 50: 1571-83 (2007) Article DOI: 10.1021/jm061159a BindingDB Entry DOI: 10.7270/Q2QV3M61
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208036 (1-methyl-3-(2-oxo-4,4-diphenyl-imidazolidin-1-yl)-...) Show SMILES C[N+]1(C[C@H]2O[C@@H]2c2ccccc2)CCC(C1)N1CC(NC1=O)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C29H31N3O2/c1-32(20-26-27(34-26)22-11-5-2-6-12-22)18-17-25(19-32)31-21-29(30-28(31)33,23-13-7-3-8-14-23)24-15-9-4-10-16-24/h2-16,25-27H,17-21H2,1H3/p+1/t25?,26-,27-,32?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	6.66	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208039 (1-methyl-3-(2-oxo-4,4-diphenyl-imidazolidin-1-yl)-...) Show SMILES C[N+]1(CCOCc2ccccc2)CCC(C1)N1CC(NC1=O)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C29H33N3O2/c1-32(19-20-34-22-24-11-5-2-6-12-24)18-17-27(21-32)31-23-29(30-28(31)33,25-13-7-3-8-14-25)26-15-9-4-10-16-26/h2-16,27H,17-23H2,1H3/p+1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank 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
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208007 (3-(1-(3-chlorobenzyl)-piperidin-4-yl)-5,5-di-(4-fl...) Show SMILES Fc1ccc(cc1)C1(CN(C2CCN(Cc3cccc(Cl)c3)CC2)C(=O)N1)c1ccc(F)cc1 Show InChI InChI=1S/C27H26ClF2N3O/c28-22-3-1-2-19(16-22)17-32-14-12-25(13-15-32)33-18-27(31-26(33)34,20-4-8-23(29)9-5-20)21-6-10-24(30)11-7-21/h1-11,16,25H,12-15,17-18H2,(H,31,34)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank 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
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHO K1 cells				J Med Chem 50: 1571-83 (2007) Article DOI: 10.1021/jm061159a BindingDB Entry DOI: 10.7270/Q2QV3M61
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208008 (3-(1-(3-hydroxybenzyl)-piperidin-4-yl)-5,5-dipheny...) Show SMILES Oc1cccc(CN2CCC(CC2)N2CC(NC2=O)(c2ccccc2)c2ccccc2)c1 Show InChI InChI=1S/C27H29N3O2/c31-25-13-7-8-21(18-25)19-29-16-14-24(15-17-29)30-20-27(28-26(30)32,22-9-3-1-4-10-22)23-11-5-2-6-12-23/h1-13,18,24,31H,14-17,19-20H2,(H,28,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHO K1 cells				J Med Chem 50: 1571-83 (2007) Article DOI: 10.1021/jm061159a BindingDB Entry DOI: 10.7270/Q2QV3M61
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208054 (1-methyl-3-(S)-(2-oxo-4,4-diphenyl-imidazolidin-1-...) Show SMILES C[N+]1(CCOc2ccccc2)CC[C@@H](C1)N1CC(NC1=O)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C28H31N3O2/c1-31(19-20-33-26-15-9-4-10-16-26)18-17-25(21-31)30-22-28(29-27(30)32,23-11-5-2-6-12-23)24-13-7-3-8-14-24/h2-16,25H,17-22H2,1H3/p+1/t25-,31?/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	7.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair

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