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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Neprilysin' and Monomerid = 50042827   
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))
BDBM50042827
PNG
(9-Mercaptomethyl-10-oxo-azecane-2-carboxylic acid ...)
Show SMILES OC(=O)C1CCCCCCC(CS)C(=O)N1
Show InChI InChI=1S/C11H19NO3S/c13-10-8(7-16)5-3-1-2-4-6-9(12-10)11(14)15/h8-9,16H,1-7H2,(H,12,13)(H,14,15)
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Article
PubMed
n/an/a 3n/an/an/an/an/an/a



Ciba-Geigy Corporation

Curated by ChEMBL


Assay Description
Inhibition of NEP 24.11 from rat kidney


J Med Chem 36: 3821-8 (1994)


Article DOI: 10.1021/jm00076a009
BindingDB Entry DOI: 10.7270/Q2ZS2X5D
More data for this
Ligand-Target Pair
Neprilysin


(Rattus norvegicus (Rat))
BDBM50042827
PNG
(9-Mercaptomethyl-10-oxo-azecane-2-carboxylic acid ...)
Show SMILES OC(=O)C1CCCCCCC(CS)C(=O)N1
Show InChI InChI=1S/C11H19NO3S/c13-10-8(7-16)5-3-1-2-4-6-9(12-10)11(14)15/h8-9,16H,1-7H2,(H,12,13)(H,14,15)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 4n/an/an/an/an/an/a



Ciba-Geigy Corporation

Curated by ChEMBL


Assay Description
Inhibition of NEP 24.11 from rat kidney


J Med Chem 36: 3821-8 (1994)


Article DOI: 10.1021/jm00076a009
BindingDB Entry DOI: 10.7270/Q2ZS2X5D
More data for this
Ligand-Target Pair