Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Bifunctional epoxide hydrolase 2' and Ligand = 'BDBM50278158'   

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))	BDBM50278158 (CHEMBL472630 | N-cyclohexyl-1-(mesitylsulfonyl)pip...) Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CCCCC1 Show InChI InChI=1S/C21H32N2O3S/c1-15-13-16(2)20(17(3)14-15)27(25,26)23-11-9-18(10-12-23)21(24)22-19-7-5-4-6-8-19/h13-14,18-19H,4-12H2,1-3H3,(H,22,24)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	16.4	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of epoxide hydrolase (unknown origin)				Bioorg Med Chem Lett 19: 2354-9 (2009) Article DOI: 10.1016/j.bmcl.2008.09.066 BindingDB Entry DOI: 10.7270/Q2J10322
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