Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Bifunctional epoxide hydrolase 2' and Ligand = 'BDBM50295544'   

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))	BDBM50295544 (CHEMBL556487 | N-(2-phenylcyclopropyl)-4-(3-(pyrid...) Show SMILES O=C(NC1CC1c1ccccc1)N1CCC(CC1)c1nc(no1)-c1ccncc1 Show InChI InChI=1S/C22H23N5O2/c28-22(24-19-14-18(19)15-4-2-1-3-5-15)27-12-8-17(9-13-27)21-25-20(26-29-21)16-6-10-23-11-7-16/h1-7,10-11,17-19H,8-9,12-14H2,(H,24,28)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	14	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 (Rattus norvegicus)	BDBM50295544 (CHEMBL556487 | N-(2-phenylcyclopropyl)-4-(3-(pyrid...) Show SMILES O=C(NC1CC1c1ccccc1)N1CCC(CC1)c1nc(no1)-c1ccncc1 Show InChI InChI=1S/C22H23N5O2/c28-22(24-19-14-18(19)15-4-2-1-3-5-15)27-12-8-17(9-13-27)21-25-20(26-29-21)16-6-10-23-11-7-16/h1-7,10-11,17-19H,8-9,12-14H2,(H,24,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	15	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
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50295544 (CHEMBL556487 | N-(2-phenylcyclopropyl)-4-(3-(pyrid...) Show SMILES O=C(NC1CC1c1ccccc1)N1CCC(CC1)c1nc(no1)-c1ccncc1 Show InChI InChI=1S/C22H23N5O2/c28-22(24-19-14-18(19)15-4-2-1-3-5-15)27-12-8-17(9-13-27)21-25-20(26-29-21)16-6-10-23-11-7-16/h1-7,10-11,17-19H,8-9,12-14H2,(H,24,28)	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
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