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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 = 'BDBM50354769'   
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))
BDBM50354769
PNG
(CHEMBL1834320)
Show SMILES COc1c(NCCNc2ccccn2)c(F)c(N)c2c1n(C)cc(C(O)=O)c2=O
Show InChI InChI=1S/C19H20FN5O4/c1-25-9-10(19(27)28)17(26)12-14(21)13(20)15(18(29-2)16(12)25)24-8-7-23-11-5-3-4-6-22-11/h3-6,9,24H,7-8,21H2,1-2H3,(H,22,23)(H,27,28)
PDB
MMDB

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Similars

Article
PubMed
n/an/a 270n/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