BDBM50020835 CHEMBL111976::[(2-Acetylsulfanyl-3-isopropyl-benzoyl)-cyclopentyl-amino]-acetic acid

SMILES: CC(C)c1cccc(C(=O)N(CC(O)=O)C2CCCC2)c1SC(C)=O

InChI Key: InChIKey=BGDRAIJPQRHWCS-UHFFFAOYSA-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 = 50020835   

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
Angiotensin-converting enzyme (Oryctolagus cuniculus)	BDBM50020835 (CHEMBL111976 | [(2-Acetylsulfanyl-3-isopropyl-benz...) Show SMILES CC(C)c1cccc(C(=O)N(CC(O)=O)C2CCCC2)c1SC(C)=O Show InChI InChI=1S/C19H25NO4S/c1-12(2)15-9-6-10-16(18(15)25-13(3)21)19(24)20(11-17(22)23)14-7-4-5-8-14/h6,9-10,12,14H,4-5,7-8,11H2,1-3H3,(H,22,23)	MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibitory activity against Angiotensin I converting enzyme				J Med Chem 28: 328-32 (1985) BindingDB Entry DOI: 10.7270/Q2DN45MJ
					More data for this Ligand-Target Pair