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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neprilysin' and Ligand = 'BDBM50396567'   
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


(Homo sapiens (Human))		BDBM50396567
PNG
(CHEMBL2171387)
Show SMILES OC(=O)CC(NC(=O)c1cc(=O)n([nH]1)-c1ccc(Cl)cc1)c1cc(Cl)ccc1Cl
Show InChI InChI=1S/C19H14Cl3N3O4/c20-10-1-4-12(5-2-10)25-17(26)8-16(24-25)19(29)23-15(9-18(27)28)13-7-11(21)3-6-14(13)22/h1-8,15,24H,9H2,(H,23,29)(H,27,28)
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Article
PubMed
n/an/a 300n/an/an/an/an/an/a



Sanofi-Aventis Deutschland GmbH

Curated by ChEMBL


Assay Description
Inhibition of human recombinant NEP using Mca-RPPGFSAFK(Dnp)-OH as substrate incubated for 15 mins prior to substrate addition measured after 20 to 3...

J Med Chem 55: 7636-49 (2012)


Article DOI: 10.1021/jm300663n
BindingDB Entry DOI: 10.7270/Q2SJ1MRZ
More data for this
Ligand-Target Pair