BDBM50050148 (S)-3-(4-Hydroxy-phenyl)-2-[(S)-2-((S)-2-mercapto-4-phenyl-butyrylamino)-3-methyl-butyrylamino]-propionic acid::CHEMBL279966

SMILES: CC(C)[C@H](NC(=O)[C@@H](S)CCc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O

InChI Key: InChIKey=IJDRKLVIHFOAFT-ACRUOGEOSA-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 = 50050148   

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)	BDBM50050148 ((S)-3-(4-Hydroxy-phenyl)-2-[(S)-2-((S)-2-mercapto-...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](S)CCc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O Show InChI InChI=1S/C24H30N2O5S/c1-15(2)21(26-22(28)20(32)13-10-16-6-4-3-5-7-16)23(29)25-19(24(30)31)14-17-8-11-18(27)12-9-17/h3-9,11-12,15,19-21,27,32H,10,13-14H2,1-2H3,(H,25,29)(H,26,28)(H,30,31)/t19-,20-,21-/m0/s1	KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60	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))	BDBM50050148 ((S)-3-(4-Hydroxy-phenyl)-2-[(S)-2-((S)-2-mercapto-...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](S)CCc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O Show InChI InChI=1S/C24H30N2O5S/c1-15(2)21(26-22(28)20(32)13-10-16-6-4-3-5-7-16)23(29)25-19(24(30)31)14-17-8-11-18(27)12-9-17/h3-9,11-12,15,19-21,27,32H,10,13-14H2,1-2H3,(H,25,29)(H,26,28)(H,30,31)/t19-,20-,21-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	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