BDBM50050137 (R)-3-Benzylsulfanyl-2-[(S)-2-((S)-2-mercapto-3-phenyl-propionylamino)-3-phenyl-propionylamino]-propionic acid::CHEMBL20966

SMILES: OC(=O)[C@H](CSCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](S)Cc1ccccc1

InChI Key: InChIKey=GOLABEZEQYPTTR-SDHOMARFSA-N

Data: 2 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 2 hits for monomerid = 50050137   

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 (Rattus norvegicus)	BDBM50050137 ((R)-3-Benzylsulfanyl-2-[(S)-2-((S)-2-mercapto-3-ph...) Show SMILES OC(=O)[C@H](CSCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](S)Cc1ccccc1 Show InChI InChI=1S/C28H30N2O4S2/c31-26(30-24(28(33)34)19-36-18-22-14-8-3-9-15-22)23(16-20-10-4-1-5-11-20)29-27(32)25(35)17-21-12-6-2-7-13-21/h1-15,23-25,35H,16-19H2,(H,29,32)(H,30,31)(H,33,34)/t23-,24-,25-/m0/s1	KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibitory activity against angiotensin I converting enzyme				J Med Chem 39: 1210-9 (1996) Article DOI: 10.1021/jm950590p BindingDB Entry DOI: 10.7270/Q2DF6RWV
					More data for this Ligand-Target Pair
Neprilysin (Oryctolagus cuniculus (rabbit))	BDBM50050137 ((R)-3-Benzylsulfanyl-2-[(S)-2-((S)-2-mercapto-3-ph...) Show SMILES OC(=O)[C@H](CSCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](S)Cc1ccccc1 Show InChI InChI=1S/C28H30N2O4S2/c31-26(30-24(28(33)34)19-36-18-22-14-8-3-9-15-22)23(16-20-10-4-1-5-11-20)29-27(32)25(35)17-21-12-6-2-7-13-21/h1-15,23-25,35H,16-19H2,(H,29,32)(H,30,31)(H,33,34)/t23-,24-,25-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibitory activity was tested against neutral endopeptidase				J Med Chem 39: 1210-9 (1996) Article DOI: 10.1021/jm950590p BindingDB Entry DOI: 10.7270/Q2DF6RWV
					More data for this Ligand-Target Pair