BDBM50048306 (S)-2-[(S)-3-Biphenyl-4-yl-2-((S)-2-mercapto-3-methyl-butyrylamino)-propionylamino]-3-(4-hydroxy-phenyl)-propionic acid::CHEMBL358338

SMILES: CC(C)[C@H](S)C(=O)N[C@@H](Cc1ccc(cc1)-c1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O

InChI Key: InChIKey=PPRRVNBFLHYEOF-GSDHBNRESA-N

Data: 4 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 4 hits for monomerid = 50048306   

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
Neutral Endopeptidase (NEP) (Rattus norvegicus (Rat))	BDBM50048306 ((S)-2-[(S)-3-Biphenyl-4-yl-2-((S)-2-mercapto-3-met...) Show SMILES CC(C)[C@H](S)C(=O)N[C@@H](Cc1ccc(cc1)-c1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O Show InChI InChI=1S/C29H32N2O5S/c1-18(2)26(37)28(34)30-24(16-19-8-12-22(13-9-19)21-6-4-3-5-7-21)27(33)31-25(29(35)36)17-20-10-14-23(32)15-11-20/h3-15,18,24-26,32,37H,16-17H2,1-2H3,(H,30,34)(H,31,33)(H,35,36)/t24-,25-,26-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of neutral endopeptidase (NEP) 24.11				Bioorg Med Chem Lett 5: 735-738 (1995) Article DOI: 10.1016/0960-894X(95)00105-3 BindingDB Entry DOI: 10.7270/Q2611097
					More data for this Ligand-Target Pair
ACEI-ACE2 (Homo sapiens (Human))	BDBM50048306 ((S)-2-[(S)-3-Biphenyl-4-yl-2-((S)-2-mercapto-3-met...) Show SMILES CC(C)[C@H](S)C(=O)N[C@@H](Cc1ccc(cc1)-c1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O Show InChI InChI=1S/C29H32N2O5S/c1-18(2)26(37)28(34)30-24(16-19-8-12-22(13-9-19)21-6-4-3-5-7-21)27(33)31-25(29(35)36)17-20-10-14-23(32)15-11-20/h3-15,18,24-26,32,37H,16-17H2,1-2H3,(H,30,34)(H,31,33)(H,35,36)/t24-,25-,26-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article	n/a	n/a	62	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of angiotensin converting enzyme (ACE)				Bioorg Med Chem Lett 5: 735-738 (1995) Article DOI: 10.1016/0960-894X(95)00105-3 BindingDB Entry DOI: 10.7270/Q2611097
					More data for this Ligand-Target Pair
Neutral Endopeptidase (NEP) (Rattus norvegicus (Rat))	BDBM50048306 ((S)-2-[(S)-3-Biphenyl-4-yl-2-((S)-2-mercapto-3-met...) Show SMILES CC(C)[C@H](S)C(=O)N[C@@H](Cc1ccc(cc1)-c1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O Show InChI InChI=1S/C29H32N2O5S/c1-18(2)26(37)28(34)30-24(16-19-8-12-22(13-9-19)21-6-4-3-5-7-21)27(33)31-25(29(35)36)17-20-10-14-23(32)15-11-20/h3-15,18,24-26,32,37H,16-17H2,1-2H3,(H,30,34)(H,31,33)(H,35,36)/t24-,25-,26-/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	28	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
Angiotensin-converting enzyme (Oryctolagus cuniculus)	BDBM50048306 ((S)-2-[(S)-3-Biphenyl-4-yl-2-((S)-2-mercapto-3-met...) Show SMILES CC(C)[C@H](S)C(=O)N[C@@H](Cc1ccc(cc1)-c1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O Show InChI InChI=1S/C29H32N2O5S/c1-18(2)26(37)28(34)30-24(16-19-8-12-22(13-9-19)21-6-4-3-5-7-21)27(33)31-25(29(35)36)17-20-10-14-23(32)15-11-20/h3-15,18,24-26,32,37H,16-17H2,1-2H3,(H,30,34)(H,31,33)(H,35,36)/t24-,25-,26-/m0/s1	MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	62	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