Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neprilysin' and Ligand = 'BDBM50050146'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Neprilysin (Oryctolagus cuniculus (rabbit))	BDBM50050146 (1-[(2S,3R)-2-((S)-2-Mercapto-3-phenyl-propionylami...) Show SMILES CC[C@@H](C)[C@H](NC(=O)[C@@H](S)Cc1ccccc1)C(=O)N1CCCC1C(O)=O Show InChI InChI=1S/C20H28N2O4S/c1-3-13(2)17(19(24)22-11-7-10-15(22)20(25)26)21-18(23)16(27)12-14-8-5-4-6-9-14/h4-6,8-9,13,15-17,27H,3,7,10-12H2,1-2H3,(H,21,23)(H,25,26)/t13-,15?,16+,17+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	24	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
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