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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 = 'BDBM50354766'   
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))
BDBM50354766
PNG
(CHEMBL1834317)
Show SMILES COc1c(NCCNc2ccccn2)c(F)c(N)c2c1n(cc(C(O)=O)c2=O)C1CCCC1
Show InChI InChI=1S/C23H26FN5O4/c1-33-22-19(28-11-10-27-15-8-4-5-9-26-15)17(24)18(25)16-20(22)29(13-6-2-3-7-13)12-14(21(16)30)23(31)32/h4-5,8-9,12-13,28H,2-3,6-7,10-11,25H2,1H3,(H,26,27)(H,31,32)
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Article
PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a



ActivX Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant full length GSK3beta after 1 hrs by luminescence assay


Bioorg Med Chem Lett 21: 5948-51 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.073
BindingDB Entry DOI: 10.7270/Q23T9HMH
More data for this
Ligand-Target Pair