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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neprilysin' and Ligand = 'BDBM50403260'   
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))
BDBM50403260
PNG
(CHEMBL53879)
Show SMILES C[C@H]1Oc2ccccc2N(CC(O)=O)C(=O)[C@H]1NC(=O)[C@@H](S)Cc1ccccc1
Show InChI InChI=1S/C21H22N2O5S/c1-13-19(22-20(26)17(29)11-14-7-3-2-4-8-14)21(27)23(12-18(24)25)15-9-5-6-10-16(15)28-13/h2-10,13,17,19,29H,11-12H2,1H3,(H,22,26)(H,24,25)/t13-,17+,19+/m1/s1
PDB

KEGG

UniProtKB/SwissProt

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DrugBank
antibodypedia
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KEGG
PC cid
PC sid
UniChem

Similars

Article
n/an/a 118n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested in vitro for inhibition of neutral endopeptidase (NEP)


Bioorg Med Chem Lett 4: 1789-1794 (1994)


Article DOI: 10.1016/S0960-894X(01)80372-3
BindingDB Entry DOI: 10.7270/Q22Z16PQ
More data for this
Ligand-Target Pair