Compile Data Set for Download or QSAR

Found 46 hits Enz. Inhib. hit(s) with all data for entry = 50042361   

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
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424629 (CHEMBL2313193) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(O)cc1 Show InChI InChI=1S/C20H24N2O4S/c1-14-3-8-19(15(2)13-14)27(25,26)22-11-9-16(10-12-22)20(24)21-17-4-6-18(23)7-5-17/h3-8,13,16,23H,9-12H2,1-2H3,(H,21,24)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.400	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424594 (CHEMBL2313183) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc2cc(ccc2c1)C(O)=O Show InChI InChI=1S/C25H26N2O5S/c1-16-3-8-23(17(2)13-16)33(31,32)27-11-9-18(10-12-27)24(28)26-22-7-6-19-14-21(25(29)30)5-4-20(19)15-22/h3-8,13-15,18H,9-12H2,1-2H3,(H,26,28)(H,29,30)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424631 (CHEMBL2313191) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccccc1Br Show InChI InChI=1S/C20H23BrN2O3S/c1-14-7-8-19(15(2)13-14)27(25,26)23-11-9-16(10-12-23)20(24)22-18-6-4-3-5-17(18)21/h3-8,13,16H,9-12H2,1-2H3,(H,22,24)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424632 (CHEMBL2313190) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccccc1F Show InChI InChI=1S/C20H23FN2O3S/c1-14-7-8-19(15(2)13-14)27(25,26)23-11-9-16(10-12-23)20(24)22-18-6-4-3-5-17(18)21/h3-8,13,16H,9-12H2,1-2H3,(H,22,24)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424630 (CHEMBL2313192) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccccc1O Show InChI InChI=1S/C20H24N2O4S/c1-14-7-8-19(15(2)13-14)27(25,26)22-11-9-16(10-12-22)20(24)21-17-5-3-4-6-18(17)23/h3-8,13,16,23H,9-12H2,1-2H3,(H,21,24)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424601 (CHEMBL2313176) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(cc1)S(=O)(=O)C(F)(F)F Show InChI InChI=1S/C21H23F3N2O5S2/c1-14-3-8-19(15(2)13-14)33(30,31)26-11-9-16(10-12-26)20(27)25-17-4-6-18(7-5-17)32(28,29)21(22,23)24/h3-8,13,16H,9-12H2,1-2H3,(H,25,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424638 (CHEMBL2313189) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NC12CC3CC(CC(C3)C1)C2 |TLB:29:20:27:23.24.25,19:20:27:23.24.25,THB:29:24:21.20.28:27,25:24:21:28.26.27,25:26:21:23.29.24| Show InChI InChI=1S/C24H34N2O3S/c1-16-3-4-22(17(2)9-16)30(28,29)26-7-5-21(6-8-26)23(27)25-24-13-18-10-19(14-24)12-20(11-18)15-24/h3-4,9,18-21H,5-8,10-15H2,1-2H3,(H,25,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424596 (CHEMBL2313181) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cnc2ccccc2c1 Show InChI InChI=1S/C23H25N3O3S/c1-16-7-8-22(17(2)13-16)30(28,29)26-11-9-18(10-12-26)23(27)25-20-14-19-5-3-4-6-21(19)24-15-20/h3-8,13-15,18H,9-12H2,1-2H3,(H,25,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.30	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424611 (CHEMBL2313166) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CCCCCCC1 Show InChI InChI=1S/C22H34N2O3S/c1-17-10-11-21(18(2)16-17)28(26,27)24-14-12-19(13-15-24)22(25)23-20-8-6-4-3-5-7-9-20/h10-11,16,19-20H,3-9,12-15H2,1-2H3,(H,23,25)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.80	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424615 (CHEMBL2313162) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CC1 Show InChI InChI=1S/C17H24N2O3S/c1-12-3-6-16(13(2)11-12)23(21,22)19-9-7-14(8-10-19)17(20)18-15-4-5-15/h3,6,11,14-15H,4-5,7-10H2,1-2H3,(H,18,20)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.60	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424635 (CHEMBL2313186) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CCCC1 Show InChI InChI=1S/C19H28N2O3S/c1-14-7-8-18(15(2)13-14)25(23,24)21-11-9-16(10-12-21)19(22)20-17-5-3-4-6-17/h7-8,13,16-17H,3-6,9-12H2,1-2H3,(H,20,22)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.20	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424616 (CHEMBL2313161) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc2OCOc2c1 Show InChI InChI=1S/C21H24N2O5S/c1-14-3-6-20(15(2)11-14)29(25,26)23-9-7-16(8-10-23)21(24)22-17-4-5-18-19(12-17)28-13-27-18/h3-6,11-12,16H,7-10,13H2,1-2H3,(H,22,24)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.20	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424637 (CHEMBL2313188) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NCC1CCCCC1 Show InChI InChI=1S/C21H32N2O3S/c1-16-8-9-20(17(2)14-16)27(25,26)23-12-10-19(11-13-23)21(24)22-15-18-6-4-3-5-7-18/h8-9,14,18-19H,3-7,10-13,15H2,1-2H3,(H,22,24)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.80	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424619 (CHEMBL2313203) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cccc2cccnc12 Show InChI InChI=1S/C23H25N3O3S/c1-16-8-9-21(17(2)15-16)30(28,29)26-13-10-19(11-14-26)23(27)25-20-7-3-5-18-6-4-12-24-22(18)20/h3-9,12,15,19H,10-11,13-14H2,1-2H3,(H,25,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424602 (CHEMBL2313175) Show SMILES CC(C)c1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2ccc(C)cc2C)cc1 Show InChI InChI=1S/C23H30N2O3S/c1-16(2)19-6-8-21(9-7-19)24-23(26)20-11-13-25(14-12-20)29(27,28)22-10-5-17(3)15-18(22)4/h5-10,15-16,20H,11-14H2,1-4H3,(H,24,26)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.70	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424610 (CHEMBL2313167) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccccc1 Show InChI InChI=1S/C20H24N2O3S/c1-15-8-9-19(16(2)14-15)26(24,25)22-12-10-17(11-13-22)20(23)21-18-6-4-3-5-7-18/h3-9,14,17H,10-13H2,1-2H3,(H,21,23)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.90	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424597 (CHEMBL2313180) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc2ccccc2c1 Show InChI InChI=1S/C24H26N2O3S/c1-17-7-10-23(18(2)15-17)30(28,29)26-13-11-20(12-14-26)24(27)25-22-9-8-19-5-3-4-6-21(19)16-22/h3-10,15-16,20H,11-14H2,1-2H3,(H,25,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.30	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424628 (CHEMBL2313194) Show SMILES COC(=O)c1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2ccc(C)cc2C)cc1 Show InChI InChI=1S/C22H26N2O5S/c1-15-4-9-20(16(2)14-15)30(27,28)24-12-10-17(11-13-24)21(25)23-19-7-5-18(6-8-19)22(26)29-3/h4-9,14,17H,10-13H2,1-3H3,(H,23,25)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.5	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424609 (CHEMBL2313168) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccccc1Cl Show InChI InChI=1S/C20H23ClN2O3S/c1-14-7-8-19(15(2)13-14)27(25,26)23-11-9-16(10-12-23)20(24)22-18-6-4-3-5-17(18)21/h3-8,13,16H,9-12H2,1-2H3,(H,22,24)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.70	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424604 (CHEMBL2313173) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C20H23N3O5S/c1-14-3-8-19(15(2)13-14)29(27,28)22-11-9-16(10-12-22)20(24)21-17-4-6-18(7-5-17)23(25)26/h3-8,13,16H,9-12H2,1-2H3,(H,21,24)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424618 (CHEMBL2313159) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc2ncccc2c1 Show InChI InChI=1S/C23H25N3O3S/c1-16-5-8-22(17(2)14-16)30(28,29)26-12-9-18(10-13-26)23(27)25-20-6-7-21-19(15-20)4-3-11-24-21/h3-8,11,14-15,18H,9-10,12-13H2,1-2H3,(H,25,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424605 (CHEMBL2313172) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(cc1)C(O)=O Show InChI InChI=1S/C21H24N2O5S/c1-14-3-8-19(15(2)13-14)29(27,28)23-11-9-16(10-12-23)20(24)22-18-6-4-17(5-7-18)21(25)26/h3-8,13,16H,9-12H2,1-2H3,(H,22,24)(H,25,26)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424633 (CHEMBL2313204) Show SMILES CC(C)CNC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(C)cc1C Show InChI InChI=1S/C18H28N2O3S/c1-13(2)12-19-18(21)16-7-9-20(10-8-16)24(22,23)17-6-5-14(3)11-15(17)4/h5-6,11,13,16H,7-10,12H2,1-4H3,(H,19,21)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424608 (CHEMBL2313169) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccccc1C Show InChI InChI=1S/C21H26N2O3S/c1-15-8-9-20(17(3)14-15)27(25,26)23-12-10-18(11-13-23)21(24)22-19-7-5-4-6-16(19)2/h4-9,14,18H,10-13H2,1-3H3,(H,22,24)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424606 (CHEMBL2313171) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C26H28N2O4S/c1-19-8-13-25(20(2)18-19)33(30,31)28-16-14-21(15-17-28)26(29)27-22-9-11-24(12-10-22)32-23-6-4-3-5-7-23/h3-13,18,21H,14-17H2,1-2H3,(H,27,29)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424626 (CHEMBL2313196) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(cc1)N1CCCCC1 Show InChI InChI=1S/C25H33N3O3S/c1-19-6-11-24(20(2)18-19)32(30,31)28-16-12-21(13-17-28)25(29)26-22-7-9-23(10-8-22)27-14-4-3-5-15-27/h6-11,18,21H,3-5,12-17H2,1-2H3,(H,26,29)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424627 (CHEMBL2313195) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(OC(F)(F)F)cc1 Show InChI InChI=1S/C21H23F3N2O4S/c1-14-3-8-19(15(2)13-14)31(28,29)26-11-9-16(10-12-26)20(27)25-17-4-6-18(7-5-17)30-21(22,23)24/h3-8,13,16H,9-12H2,1-2H3,(H,25,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424595 (CHEMBL2313182) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cccc2cnccc12 Show InChI InChI=1S/C23H25N3O3S/c1-16-6-7-22(17(2)14-16)30(28,29)26-12-9-18(10-13-26)23(27)25-21-5-3-4-19-15-24-11-8-20(19)21/h3-8,11,14-15,18H,9-10,12-13H2,1-2H3,(H,25,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424621 (CHEMBL2313201) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C20H22Cl2N2O3S/c1-13-3-4-19(14(2)9-13)28(26,27)24-7-5-15(6-8-24)20(25)23-18-11-16(21)10-17(22)12-18/h3-4,9-12,15H,5-8H2,1-2H3,(H,23,25)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424607 (CHEMBL2313170) Show SMILES COc1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2ccc(C)cc2C)cc1 Show InChI InChI=1S/C21H26N2O4S/c1-15-4-9-20(16(2)14-15)28(25,26)23-12-10-17(11-13-23)21(24)22-18-5-7-19(27-3)8-6-18/h4-9,14,17H,10-13H2,1-3H3,(H,22,24)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424614 (CHEMBL2313163) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CCC1 Show InChI InChI=1S/C18H26N2O3S/c1-13-6-7-17(14(2)12-13)24(22,23)20-10-8-15(9-11-20)18(21)19-16-4-3-5-16/h6-7,12,15-16H,3-5,8-11H2,1-2H3,(H,19,21)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424624 (CHEMBL2313198) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C21H23F3N2O3S/c1-14-3-8-19(15(2)13-14)30(28,29)26-11-9-16(10-12-26)20(27)25-18-6-4-17(5-7-18)21(22,23)24/h3-8,13,16H,9-12H2,1-2H3,(H,25,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424612 (CHEMBL2313165) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CCCc2ccccc12 Show InChI InChI=1S/C24H30N2O3S/c1-17-10-11-23(18(2)16-17)30(28,29)26-14-12-20(13-15-26)24(27)25-22-9-5-7-19-6-3-4-8-21(19)22/h3-4,6,8,10-11,16,20,22H,5,7,9,12-15H2,1-2H3,(H,25,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	41	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424603 (CHEMBL2313174) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(N2CCCCC2)c(c1)C(N)=O Show InChI InChI=1S/C26H34N4O4S/c1-18-6-9-24(19(2)16-18)35(33,34)30-14-10-20(11-15-30)26(32)28-21-7-8-23(22(17-21)25(27)31)29-12-4-3-5-13-29/h6-9,16-17,20H,3-5,10-15H2,1-2H3,(H2,27,31)(H,28,32)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	43	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424599 (CHEMBL2313178) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(Br)cc1 Show InChI InChI=1S/C20H23BrN2O3S/c1-14-3-8-19(15(2)13-14)27(25,26)23-11-9-16(10-12-23)20(24)22-18-6-4-17(21)5-7-18/h3-8,13,16H,9-12H2,1-2H3,(H,22,24)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424620 (CHEMBL2313202) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C20H22Cl2N2O3S/c1-13-3-6-19(14(2)11-13)28(26,27)24-9-7-15(8-10-24)20(25)23-16-4-5-17(21)18(22)12-16/h3-6,11-12,15H,7-10H2,1-2H3,(H,23,25)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424598 (CHEMBL2313179) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(Cl)c(c1)C(F)(F)F Show InChI InChI=1S/C21H22ClF3N2O3S/c1-13-3-6-19(14(2)11-13)31(29,30)27-9-7-15(8-10-27)20(28)26-16-4-5-18(22)17(12-16)21(23,24)25/h3-6,11-12,15H,7-10H2,1-2H3,(H,26,28)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	78	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424613 (CHEMBL2313164) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CCCCC1 Show InChI InChI=1S/C20H30N2O3S/c1-15-8-9-19(16(2)14-15)26(24,25)22-12-10-17(11-13-22)20(23)21-18-6-4-3-5-7-18/h8-9,14,17-18H,3-7,10-13H2,1-2H3,(H,21,23)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	102	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424617 (CHEMBL2313160) Show SMILES COC(=O)c1ccc2cc(NC(=O)C3CCN(CC3)S(=O)(=O)c3ccc(C)cc3C)ccc2c1 Show InChI InChI=1S/C26H28N2O5S/c1-17-4-9-24(18(2)14-17)34(31,32)28-12-10-19(11-13-28)25(29)27-23-8-7-20-15-22(26(30)33-3)6-5-21(20)16-23/h4-9,14-16,19H,10-13H2,1-3H3,(H,27,29)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424625 (CHEMBL2313197) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(cc1)N1CCOCC1 Show InChI InChI=1S/C24H31N3O4S/c1-18-3-8-23(19(2)17-18)32(29,30)27-11-9-20(10-12-27)24(28)25-21-4-6-22(7-5-21)26-13-15-31-16-14-26/h3-8,17,20H,9-16H2,1-2H3,(H,25,28)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424636 (CHEMBL2313187) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CCN(CC1)C(=O)OC(C)(C)C Show InChI InChI=1S/C24H37N3O5S/c1-17-6-7-21(18(2)16-17)33(30,31)27-14-8-19(9-15-27)22(28)25-20-10-12-26(13-11-20)23(29)32-24(3,4)5/h6-7,16,19-20H,8-15H2,1-5H3,(H,25,28)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	263	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424600 (CHEMBL2313177) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(F)cc1 Show InChI InChI=1S/C20H23FN2O3S/c1-14-3-8-19(15(2)13-14)27(25,26)23-11-9-16(10-12-23)20(24)22-18-6-4-17(21)5-7-18/h3-8,13,16H,9-12H2,1-2H3,(H,22,24)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	290	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424623 (CHEMBL2313199) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cccc(c1)C(F)(F)F Show InChI InChI=1S/C21H23F3N2O3S/c1-14-6-7-19(15(2)12-14)30(28,29)26-10-8-16(9-11-26)20(27)25-18-5-3-4-17(13-18)21(22,23)24/h3-7,12-13,16H,8-11H2,1-2H3,(H,25,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	640	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424622 (CHEMBL2313200) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(Cl)cc1 Show InChI InChI=1S/C20H23ClN2O3S/c1-14-3-8-19(15(2)13-14)27(25,26)23-11-9-16(10-12-23)20(24)22-18-6-4-17(21)5-7-18/h3-8,13,16H,9-12H2,1-2H3,(H,22,24)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424634 (CHEMBL2313185) Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)N[C@H]1C[C@@H]1c1ccccc1 |r| Show InChI InChI=1S/C23H28N2O3S/c1-16-8-9-22(17(2)14-16)29(27,28)25-12-10-19(11-13-25)23(26)24-21-15-20(21)18-6-4-3-5-7-18/h3-9,14,19-21H,10-13,15H2,1-2H3,(H,24,26)/t20-,21+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50424593 (CHEMBL2313184) Show SMILES COc1cc2OCOc2cc1NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(C)cc1C Show InChI InChI=1S/C22H26N2O6S/c1-14-4-5-21(15(2)10-14)31(26,27)24-8-6-16(7-9-24)22(25)23-17-11-19-20(30-13-29-19)12-18(17)28-3/h4-5,10-12,16H,6-9,13H2,1-3H3,(H,23,25)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of human sEH assessed as 6-methoxy-2-naphthaldehyde generation preincubated for 10 before addition of cyano(2-methyl-oxynaphthalen-6-yl)me...				Bioorg Med Chem Lett 23: 417-21 (2012) Article DOI: 10.1016/j.bmcl.2012.11.084 BindingDB Entry DOI: 10.7270/Q2Z60QBJ
					More data for this Ligand-Target Pair