BDBM50021143 6-Benzyloxycarbonylamino-2-(1-carboxymethyl-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-3-ylamino)-hexanoic acid ethyl ester::CHEMBL289618

SMILES: CCOC(=O)[C@H](CCCCNC(=O)OCc1ccccc1)N[C@H]1CCc2ccccc2N(CC(O)=O)C1=O

InChI Key: InChIKey=SGWDRFQPAPSOTL-GOTSBHOMSA-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 = 50021143   

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))	BDBM50021143 (6-Benzyloxycarbonylamino-2-(1-carboxymethyl-2-oxo-...) Show SMILES CCOC(=O)[C@H](CCCCNC(=O)OCc1ccccc1)N[C@H]1CCc2ccccc2N(CC(O)=O)C1=O Show InChI InChI=1S/C28H35N3O7/c1-2-37-27(35)23(13-8-9-17-29-28(36)38-19-20-10-4-3-5-11-20)30-22-16-15-21-12-6-7-14-24(21)31(26(22)34)18-25(32)33/h3-7,10-12,14,22-23,30H,2,8-9,13,15-19H2,1H3,(H,29,36)(H,32,33)/t22-,23-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	15	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