BDBM50403255 CHEMBL50559

SMILES: C[C@@H]1Oc2ccccc2N(CC(O)=O)C(=O)[C@H]1NC(=O)[C@@H](S)Cc1ccccc1

InChI Key: InChIKey=PRNNUULGNBSAAT-IXDGSTSKSA-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 = 50403255   

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))	BDBM50403255 (CHEMBL50559) Show SMILES C[C@@H]1Oc2ccccc2N(CC(O)=O)C(=O)[C@H]1NC(=O)[C@@H](S)Cc1ccccc1 Show InChI InChI=1S/C21H22N2O5S/c1-13-19(22-20(26)17(29)11-14-7-3-2-4-8-14)21(27)23(12-18(24)25)15-9-5-6-10-16(15)28-13/h2-10,13,17,19,29H,11-12H2,1H3,(H,22,26)(H,24,25)/t13-,17-,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested in vitro for inhibition of Angiotensin converting enzyme (ACE)				Bioorg Med Chem Lett 4: 1789-1794 (1994) Article DOI: 10.1016/S0960-894X(01)80372-3 BindingDB Entry DOI: 10.7270/Q22Z16PQ
					More data for this Ligand-Target Pair
Neprilysin (Homo sapiens (Human))	BDBM50403255 (CHEMBL50559) Show SMILES C[C@@H]1Oc2ccccc2N(CC(O)=O)C(=O)[C@H]1NC(=O)[C@@H](S)Cc1ccccc1 Show InChI InChI=1S/C21H22N2O5S/c1-13-19(22-20(26)17(29)11-14-7-3-2-4-8-14)21(27)23(12-18(24)25)15-9-5-6-10-16(15)28-13/h2-10,13,17,19,29H,11-12H2,1H3,(H,22,26)(H,24,25)/t13-,17-,19-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article	n/a	n/a	5.20	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested in vitro for inhibition of neutral endopeptidase (NEP)				Bioorg Med Chem Lett 4: 1789-1794 (1994) Article DOI: 10.1016/S0960-894X(01)80372-3 BindingDB Entry DOI: 10.7270/Q22Z16PQ
					More data for this Ligand-Target Pair