BDBM50021145 2-(1-Carboxymethyl-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-3-ylamino)-hexanoic acid ethyl ester::CHEMBL40709

SMILES: CCCC[C@H](N[C@H]1CCc2ccccc2N(CC(O)=O)C1=O)C(=O)OCC

InChI Key: InChIKey=CLYQVSLBVFEZBT-HOTGVXAUSA-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 = 50021145   

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 (Homo sapiens (Human))	BDBM50021145 (2-(1-Carboxymethyl-2-oxo-2,3,4,5-tetrahydro-1H-ben...) Show SMILES CCCC[C@H](N[C@H]1CCc2ccccc2N(CC(O)=O)C1=O)C(=O)OCC Show InChI InChI=1S/C20H28N2O5/c1-3-5-9-16(20(26)27-4-2)21-15-12-11-14-8-6-7-10-17(14)22(19(15)25)13-18(23)24/h6-8,10,15-16,21H,3-5,9,11-13H2,1-2H3,(H,23,24)/t15-,16-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	2.60E+3	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: 1603-6 (1985) BindingDB Entry DOI: 10.7270/Q2ZK5H7D
					More data for this Ligand-Target Pair