BDBM50048324 (S)-3-(4-Hydroxy-phenyl)-2-[2-((S)-2-mercapto-3-methyl-butyrylamino)-2-methyl-propionylamino]-propionic acid::CHEMBL144543

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

InChI Key: InChIKey=PRVUPIUSKGAJMJ-KBPBESRZSA-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 = 50048324   

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)	BDBM50048324 ((S)-3-(4-Hydroxy-phenyl)-2-[2-((S)-2-mercapto-3-me...) Show SMILES CC(C)[C@H](S)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O Show InChI InChI=1S/C18H26N2O5S/c1-10(2)14(26)15(22)20-18(3,4)17(25)19-13(16(23)24)9-11-5-7-12(21)8-6-11/h5-8,10,13-14,21,26H,9H2,1-4H3,(H,19,25)(H,20,22)(H,23,24)/t13-,14-/m0/s1	MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
CIBA-GEIGY Corporation Curated by ChEMBL					Assay Description Evaluation of in vitro inhibitory activity against Angiotensin I converting enzyme				J Med Chem 38: 5023-30 (1996) BindingDB Entry DOI: 10.7270/Q26D5TMH
					More data for this Ligand-Target Pair
Neutral Endopeptidase (NEP) (Rattus norvegicus (Rat))	BDBM50048324 ((S)-3-(4-Hydroxy-phenyl)-2-[2-((S)-2-mercapto-3-me...) Show SMILES CC(C)[C@H](S)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O Show InChI InChI=1S/C18H26N2O5S/c1-10(2)14(26)15(22)20-18(3,4)17(25)19-13(16(23)24)9-11-5-7-12(21)8-6-11/h5-8,10,13-14,21,26H,9H2,1-4H3,(H,19,25)(H,20,22)(H,23,24)/t13-,14-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	9.20	n/a	n/a	n/a	n/a	n/a	n/a
CIBA-GEIGY Corporation Curated by ChEMBL					Assay Description Evaluation of in vitro inhibitory activity against Neutral endopeptidase				J Med Chem 38: 5023-30 (1996) BindingDB Entry DOI: 10.7270/Q26D5TMH
					More data for this Ligand-Target Pair