BDBM50436439 CHEMBL2397145

SMILES: CNC(=O)c1cccc(O[C@H]2CC[C@@H](CC2)NC(=O)Nc2ccc(Cl)c(c2)C(F)(F)F)c1

InChI Key: InChIKey=TXYLJBZWPCKJLZ-KOMQPUFPSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50436439   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
EBifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50436439 (CHEMBL2397145) Show SMILES CNC(=O)c1cccc(O[C@H]2CC[C@@H](CC2)NC(=O)Nc2ccc(Cl)c(c2)C(F)(F)F)c1 |r,wU:10.9,wD:13.16,(59.23,-22.43,;59.23,-20.89,;57.89,-20.12,;57.89,-18.58,;56.56,-20.89,;56.56,-22.44,;55.22,-23.21,;53.89,-22.43,;53.9,-20.89,;52.57,-20.12,;51.23,-20.88,;51.23,-22.42,;49.9,-23.19,;48.57,-22.42,;48.57,-20.88,;49.9,-20.11,;47.24,-23.2,;45.9,-22.43,;45.9,-20.89,;44.57,-23.2,;43.24,-22.43,;41.92,-23.2,;40.58,-22.44,;40.57,-20.89,;39.24,-20.13,;41.91,-20.12,;43.24,-20.89,;41.91,-18.58,;43.24,-17.81,;40.57,-17.81,;41.89,-17.03,;55.23,-20.13,)| Show InChI InChI=1S/C22H23ClF3N3O3/c1-27-20(30)13-3-2-4-17(11-13)32-16-8-5-14(6-9-16)28-21(31)29-15-7-10-19(23)18(12-15)22(24,25)26/h2-4,7,10-12,14,16H,5-6,8-9H2,1H3,(H,27,30)(H2,28,29,31)/t14-,16-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibition of human recombinant soluble epoxide hydrolase assessed as cyano(6-methoxy-naphthalen-2-yl)methyl trans-[(3-phenyloxyran-2-yl)methyl] carb...				Bioorg Med Chem Lett 23: 3732-7 (2013) Article DOI: 10.1016/j.bmcl.2013.05.011 BindingDB Entry DOI: 10.7270/Q2057HBP
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