Compile Data Set for Download or QSAR

Found 21 hits with Last Name = 'coleman' and Initial = 'rs'   

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
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419607 (CHEMBL1940793) Show SMILES Fc1ccccc1NC(=O)CN1CCN(CC1)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C18H20FN3O3S/c19-16-8-4-5-9-17(16)20-18(23)14-21-10-12-22(13-11-21)26(24,25)15-6-2-1-3-7-15/h1-9H,10-14H2,(H,20,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as inhibition of epibatidine-induced calcium mobiliza...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419601 (CHEMBL1940786) Show SMILES Fc1ccc(cc1)S(=O)(=O)N1CCN(CC(=O)Nc2ccc3[nH]ncc3c2)CC1 Show InChI InChI=1S/C19H20FN5O3S/c20-15-1-4-17(5-2-15)29(27,28)25-9-7-24(8-10-25)13-19(26)22-16-3-6-18-14(11-16)12-21-23-18/h1-6,11-12H,7-10,13H2,(H,21,23)(H,22,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as inhibition of epibatidine-induced calcium mobiliza...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419609 (CHEMBL1940795) Show SMILES Fc1ccc(NC(=O)CN2CCN(CC2)S(=O)(=O)c2ccccc2F)cc1 Show InChI InChI=1S/C18H19F2N3O3S/c19-14-5-7-15(8-6-14)21-18(24)13-22-9-11-23(12-10-22)27(25,26)17-4-2-1-3-16(17)20/h1-8H,9-13H2,(H,21,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as inhibition of epibatidine-induced calcium mobiliza...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419605 (CHEMBL1940791) Show SMILES Fc1ccccc1NC(=O)CN1CCN(CC1)S(=O)(=O)c1ccccc1F Show InChI InChI=1S/C18H19F2N3O3S/c19-14-5-1-3-7-16(14)21-18(24)13-22-9-11-23(12-10-22)27(25,26)17-8-4-2-6-15(17)20/h1-8H,9-13H2,(H,21,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as inhibition of epibatidine-induced calcium mobiliza...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50382406 (CHEMBL1606364) Show SMILES Fc1ccc(cc1)S(=O)(=O)N1CCN(CC(=O)Nc2ccccc2F)CC1 Show InChI InChI=1S/C18H19F2N3O3S/c19-14-5-7-15(8-6-14)27(25,26)23-11-9-22(10-12-23)13-18(24)21-17-4-2-1-3-16(17)20/h1-8H,9-13H2,(H,21,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as inhibition of epibatidine-induced calcium mobiliza...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419613 (CHEMBL1940802) Show SMILES O=C(CN1CCN(CC1)S(=O)(=O)c1ccccc1)Nc1ccccc1 Show InChI InChI=1S/C18H21N3O3S/c22-18(19-16-7-3-1-4-8-16)15-20-11-13-21(14-12-20)25(23,24)17-9-5-2-6-10-17/h1-10H,11-15H2,(H,19,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as inhibition of epibatidine-induced calcium mobiliza...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419614 (CHEMBL1940804) Show SMILES Fc1ccc(cc1)S(=O)(=O)N1CCN(CC(=O)Oc2ccccc2-c2ccccc2)CC1 Show InChI InChI=1S/C24H23FN2O4S/c25-20-10-12-21(13-11-20)32(29,30)27-16-14-26(15-17-27)18-24(28)31-23-9-5-4-8-22(23)19-6-2-1-3-7-19/h1-13H,14-18H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.22E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as inhibition of epibatidine-induced calcium mobiliza...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419611 (CHEMBL1940797) Show SMILES COC(=O)c1ccc(NC(=O)CN2CCN(CC2)S(=O)(=O)c2ccccc2F)cc1 Show InChI InChI=1S/C20H22FN3O5S/c1-29-20(26)15-6-8-16(9-7-15)22-19(25)14-23-10-12-24(13-11-23)30(27,28)18-5-3-2-4-17(18)21/h2-9H,10-14H2,1H3,(H,22,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.24E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as inhibition of epibatidine-induced calcium mobiliza...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419608 (CHEMBL1940794) Show SMILES COc1ccc(cc1)S(=O)(=O)N1CCN(CC(=O)Nc2ccccc2F)CC1 Show InChI InChI=1S/C19H22FN3O4S/c1-27-15-6-8-16(9-7-15)28(25,26)23-12-10-22(11-13-23)14-19(24)21-18-5-3-2-4-17(18)20/h2-9H,10-14H2,1H3,(H,21,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.34E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as inhibition of epibatidine-induced calcium mobiliza...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419603 (CHEMBL1940789) Show SMILES Fc1ccc(NC(=O)CN2CCN(CC2)S(=O)(=O)c2ccc(F)cc2)cc1 Show InChI InChI=1S/C18H19F2N3O3S/c19-14-1-5-16(6-2-14)21-18(24)13-22-9-11-23(12-10-22)27(25,26)17-7-3-15(20)4-8-17/h1-8H,9-13H2,(H,21,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.38E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as inhibition of epibatidine-induced calcium mobiliza...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419604 (CHEMBL1940790) Show SMILES Fc1ccc(cc1)S(=O)(=O)N1CCN(CC(=O)Nc2ccccc2)CC1 Show InChI InChI=1S/C18H20FN3O3S/c19-15-6-8-17(9-7-15)26(24,25)22-12-10-21(11-13-22)14-18(23)20-16-4-2-1-3-5-16/h1-9H,10-14H2,(H,20,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.49E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as inhibition of epibatidine-induced calcium mobiliza...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419610 (CHEMBL1940796) Show SMILES COc1ccc(NC(=O)CN2CCN(CC2)S(=O)(=O)c2ccccc2F)cc1 Show InChI InChI=1S/C19H22FN3O4S/c1-27-16-8-6-15(7-9-16)21-19(24)14-22-10-12-23(13-11-22)28(25,26)18-5-3-2-4-17(18)20/h2-9H,10-14H2,1H3,(H,21,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.71E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as inhibition of epibatidine-induced calcium mobiliza...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419606 (CHEMBL1940792) Show SMILES Fc1ccccc1NC(=O)CN1CCN(CC1)S(=O)(=O)c1cccnc1 Show InChI InChI=1S/C17H19FN4O3S/c18-15-5-1-2-6-16(15)20-17(23)13-21-8-10-22(11-9-21)26(24,25)14-4-3-7-19-12-14/h1-7,12H,8-11,13H2,(H,20,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as inhibition of epibatidine-induced calcium mobiliza...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419615 (CHEMBL1940805) Show SMILES Fc1ccccc1S(=O)(=O)N1CCN(CC(=O)Oc2ccccc2-c2ccccc2)CC1 Show InChI InChI=1S/C24H23FN2O4S/c25-21-11-5-7-13-23(21)32(29,30)27-16-14-26(15-17-27)18-24(28)31-22-12-6-4-10-20(22)19-8-2-1-3-9-19/h1-13H,14-18H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.09E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as inhibition of epibatidine-induced calcium mobiliza...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419602 (CHEMBL1940788) Show SMILES COc1ccc(NC(=O)CN2CCN(CC2)S(=O)(=O)c2ccc(F)cc2)cc1 Show InChI InChI=1S/C19H22FN3O4S/c1-27-17-6-4-16(5-7-17)21-19(24)14-22-10-12-23(13-11-22)28(25,26)18-8-2-15(20)3-9-18/h2-9H,10-14H2,1H3,(H,21,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.11E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as inhibition of epibatidine-induced calcium mobiliza...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419618 (CHEMBL1940803) Show SMILES COc1ccc(cc1)S(=O)(=O)N1CCN(CC(=O)Nc2ccc(F)cc2)CC1 Show InChI InChI=1S/C19H22FN3O4S/c1-27-17-6-8-18(9-7-17)28(25,26)23-12-10-22(11-13-23)14-19(24)21-16-4-2-15(20)3-5-16/h2-9H,10-14H2,1H3,(H,21,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.38E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as inhibition of epibatidine-induced calcium mobiliza...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419612 (CHEMBL1940800) Show SMILES O=C(CN1CCN(CC1)S(=O)(=O)c1cccnc1)Nc1ccn[nH]1 Show InChI InChI=1S/C14H18N6O3S/c21-14(17-13-3-5-16-18-13)11-19-6-8-20(9-7-19)24(22,23)12-2-1-4-15-10-12/h1-5,10H,6-9,11H2,(H2,16,17,18,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as inhibition of epibatidine-induced calcium mobiliza...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419617 (CHEMBL1940787) Show SMILES Fc1ccc(cc1)S(=O)(=O)N1CCN(CC(=O)Nc2ccn[nH]2)CC1 Show InChI InChI=1S/C15H18FN5O3S/c16-12-1-3-13(4-2-12)25(23,24)21-9-7-20(8-10-21)11-15(22)18-14-5-6-17-19-14/h1-6H,7-11H2,(H2,17,18,19,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as decrease in epibatidine-induced calcium mobilizati...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419616 (CHEMBL1940801) Show SMILES COc1ccc(NC(=O)CN2CCN(CC2)S(=O)(=O)c2cccnc2)cc1 Show InChI InChI=1S/C18H22N4O4S/c1-26-16-6-4-15(5-7-16)20-18(23)14-21-9-11-22(12-10-21)27(24,25)17-3-2-8-19-13-17/h2-8,13H,9-12,14H2,1H3,(H,20,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as decrease in epibatidine-induced calcium mobilizati...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419599 (CHEMBL1940798) Show SMILES OC(=O)c1ccc(NC(=O)CN2CCN(CC2)S(=O)(=O)c2ccccc2F)cc1 Show InChI InChI=1S/C19H20FN3O5S/c20-16-3-1-2-4-17(16)29(27,28)23-11-9-22(10-12-23)13-18(24)21-15-7-5-14(6-8-15)19(25)26/h1-8H,9-13H2,(H,21,24)(H,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as decrease in epibatidine-induced calcium mobilizati...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Homo sapiens (Human))	BDBM50419600 (CHEMBL1940799) Show SMILES Fc1ccccc1S(=O)(=O)N1CCN(CC(=O)Nc2ccn[nH]2)CC1 Show InChI InChI=1S/C15H18FN5O3S/c16-12-3-1-2-4-13(12)25(23,24)21-9-7-20(8-10-21)11-15(22)18-14-5-6-17-19-14/h1-6H,7-11H2,(H2,17,18,19,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
The Ohio State University Curated by ChEMBL					Assay Description Negative allosteric modulation of human nAChR alpha4beta2 expressed in HEK ts201 cells assessed as decrease in epibatidine-induced calcium mobilizati...				J Med Chem 54: 8681-92 (2011) Article DOI: 10.1021/jm201294r BindingDB Entry DOI: 10.7270/Q2057H6W
					More data for this Ligand-Target Pair