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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neprilysin' and Ligand = 'BDBM50039541'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Neprilysin


(Oryctolagus cuniculus (rabbit))		BDBM50039541
PNG
((S)-2-((S)-2-Mercaptomethyl-3-naphthalen-1-yl-prop...)
Show SMILES Cc1ccc(CSC[C@@H](NC(=O)[C@@H](CS)Cc2cccc3ccccc23)C(O)=O)cc1
Show InChI InChI=1S/C25H27NO3S2/c1-17-9-11-18(12-10-17)15-31-16-23(25(28)29)26-24(27)21(14-30)13-20-7-4-6-19-5-2-3-8-22(19)20/h2-12,21,23,30H,13-16H2,1H3,(H,26,27)(H,28,29)/t21-,23-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 2n/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against neutral endopeptidase (NEP)

J Med Chem 37: 2461-76 (1994)


BindingDB Entry DOI: 10.7270/Q2571B20
More data for this
Ligand-Target Pair