BDBM50336821 4-cyano-N-[(1S,2R)-2-phenylcyclopropyl]benzamide::CHEMBL1615212::rac-4-Cyano-N-(trans-2-phenylcyclopropyl)benzamide

SMILES: O=C(N[C@H]1C[C@@H]1c1ccccc1)c1ccc(cc1)C#N

InChI Key: InChIKey=RPFFDFASGIBGIP-CVEARBPZSA-N

Data: 1 IC50

PDB links: 1 PDB ID matches this monomer.

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 = 50336821   

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
Epoxide hydratase (Homo sapiens (Human))	BDBM50336821 (4-cyano-N-[(1S,2R)-2-phenylcyclopropyl]benzamide |...) Show SMILES O=C(N[C@H]1C[C@@H]1c1ccccc1)c1ccc(cc1)C#N Show InChI InChI=1S/C17H14N2O/c18-11-12-6-8-14(9-7-12)17(20)19-16-10-15(16)13-4-2-1-3-5-13/h1-9,15-16H,10H2,(H,19,20)/t15-,16+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar	CHEMBL MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	565	n/a	n/a	n/a	n/a	n/a	n/a
Dainippon Sumitomo Pharma Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of human soluble epoxide hydrolase in cell free system				J Med Chem 54: 851-7 (2012) Article DOI: 10.1021/jm101273e BindingDB Entry DOI: 10.7270/Q2M046F1
					More data for this Ligand-Target Pair				3D Structure (crystal)