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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neprilysin' and Ligand = 'BDBM50025922'   
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


(Rattus norvegicus (Rat))
BDBM50025922
PNG
(2-Benzyl-N*4*-hydroxy-N*1*-[(3-methyl-butylcarbamo...)
Show SMILES CC(C)CCNC(=O)CNC(=O)C(CC(=O)NO)Cc1ccccc1
Show InChI InChI=1S/C18H27N3O4/c1-13(2)8-9-19-17(23)12-20-18(24)15(11-16(22)21-25)10-14-6-4-3-5-7-14/h3-7,13,15,25H,8-12H2,1-2H3,(H,19,23)(H,20,24)(H,21,22)
PDB
MMDB

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Similars

PubMed
n/an/a 600n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of enkephalinase purified from rat kidney.


J Med Chem 28: 1158-69 (1985)


BindingDB Entry DOI: 10.7270/Q20C4WB5
More data for this
Ligand-Target Pair