Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Bifunctional epoxide hydrolase 2' and Ligand = 'BDBM50296190'   

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))	BDBM50296190 (1-tert-butyl-3-(3-(3-morpholinopropoxy)phenyl)urea...) Show SMILES CC(C)(C)NC(=O)Nc1cccc(OCCCN2CCOCC2)c1 Show InChI InChI=1S/C18H29N3O3/c1-18(2,3)20-17(22)19-15-6-4-7-16(14-15)24-11-5-8-21-9-12-23-13-10-21/h4,6-7,14H,5,8-13H2,1-3H3,(H2,19,20,22)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.04E+3	n/a	n/a	n/a	n/a	n/a	n/a
Arete Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibition of human soluble epoxide hydrolase by fluorescent endpoint assay				Bioorg Med Chem Lett 19: 4259-63 (2009) Article DOI: 10.1016/j.bmcl.2009.05.102 BindingDB Entry DOI: 10.7270/Q2VQ32Q0
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