Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Bifunctional epoxide hydrolase 2' and Ligand = 'BDBM50295549'   

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))	BDBM50295549 (4-(3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl)-N-(4-(tr...) Show SMILES FC(F)(F)c1ccc(NC(=O)N2CCC(CC2)c2nc(no2)-c2ccccn2)cc1 Show InChI InChI=1S/C20H18F3N5O2/c21-20(22,23)14-4-6-15(7-5-14)25-19(29)28-11-8-13(9-12-28)18-26-17(27-30-18)16-3-1-2-10-24-16/h1-7,10,13H,8-9,11-12H2,(H,25,29)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of human sEH				J Med Chem 52: 5009-12 (2010) Article DOI: 10.1021/jm900725r BindingDB Entry DOI: 10.7270/Q2TX3G8W
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50295549 (4-(3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl)-N-(4-(tr...) Show SMILES FC(F)(F)c1ccc(NC(=O)N2CCC(CC2)c2nc(no2)-c2ccccn2)cc1 Show InChI InChI=1S/C20H18F3N5O2/c21-20(22,23)14-4-6-15(7-5-14)25-19(29)28-11-8-13(9-12-28)18-26-17(27-30-18)16-3-1-2-10-24-16/h1-7,10,13H,8-9,11-12H2,(H,25,29)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of human sEH in HEK293 cells assessed as conversion of 14,15-epoxyeicosatrienoic acid to 14,15-dihydroepoxyeicosatrienoic acid				J Med Chem 52: 5009-12 (2010) Article DOI: 10.1021/jm900725r BindingDB Entry DOI: 10.7270/Q2TX3G8W
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Rattus norvegicus)	BDBM50295549 (4-(3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl)-N-(4-(tr...) Show SMILES FC(F)(F)c1ccc(NC(=O)N2CCC(CC2)c2nc(no2)-c2ccccn2)cc1 Show InChI InChI=1S/C20H18F3N5O2/c21-20(22,23)14-4-6-15(7-5-14)25-19(29)28-11-8-13(9-12-28)18-26-17(27-30-18)16-3-1-2-10-24-16/h1-7,10,13H,8-9,11-12H2,(H,25,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD 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
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of rat sEH				J Med Chem 52: 5009-12 (2010) Article DOI: 10.1021/jm900725r BindingDB Entry DOI: 10.7270/Q2TX3G8W
					More data for this Ligand-Target Pair