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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glycogen synthase kinase-3 beta' and Ligand = 'BDBM50293683'   
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
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM50293683
PNG
(2-(2-methoxyphenylthio)-N-(5-methyl-1H-pyrazol-3-y...)
Show SMILES COc1ccccc1Sc1nc(Nc2cc(C)n[nH]2)c2ccccc2n1
Show InChI InChI=1S/C19H17N5OS/c1-12-11-17(24-23-12)21-18-13-7-3-4-8-14(13)20-19(22-18)26-16-10-6-5-9-15(16)25-2/h3-11H,1-2H3,(H2,20,21,22,23,24)
PDB
MMDB

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PC cid
PC sid
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Patents

Article
PubMed
216n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals (Europe) Ltd

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta


Bioorg Med Chem Lett 19: 3586-92 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.136
BindingDB Entry DOI: 10.7270/Q28K7944
More data for this
Ligand-Target Pair