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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM50487243'   
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
Acetylcholinesterase


(Drosophila melanogaster)
BDBM50487243
PNG
(CHEBI:28006 | O,O-DIETHYL S-HYDROGEN PHOSPHOROTHIO...)
Show SMILES CCOP(O)(=S)OCC
Show InChI InChI=1S/C4H11O3PS/c1-3-6-8(5,9)7-4-2/h3-4H2,1-2H3,(H,5,9)
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KEGG
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/a>4.00E+7n/an/an/an/an/an/a



Chinese Academy of Agricultural Sciences

Curated by ChEMBL


Assay Description
Inhibition of acetylcholinesterase in Drosophila melanogaster brain by Ellman's method


Bioorg Med Chem Lett 21: 6404-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.098
BindingDB Entry DOI: 10.7270/Q2BP05PN
More data for this
Ligand-Target Pair