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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neprilysin' and Ligand = 'BDBM50373670'   
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))
BDBM50373670
PNG
(CHEMBL402569)
Show SMILES O[C@@H](CN(CC1CCCCC1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O)C(O)=O
Show InChI InChI=1S/C20H28N2O7/c23-15-8-6-13(7-9-15)10-16(18(25)26)21-20(29)22(12-17(24)19(27)28)11-14-4-2-1-3-5-14/h6-9,14,16-17,23-24H,1-5,10-12H2,(H,21,29)(H,25,26)(H,27,28)/t16-,17-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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DrugBank
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KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.54E+3n/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Inhibition of NEP


Bioorg Med Chem Lett 18: 1058-62 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.013
BindingDB Entry DOI: 10.7270/Q23N2483
More data for this
Ligand-Target Pair