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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 = 'BDBM50267520'   
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))
BDBM50267520
PNG
(3-(5-Fluoro-1-methyl-1H-indol-3-yl)-4-(6-hydroxybe...)
Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2coc3cc(O)ccc23)c2cc(F)ccc12 |t:4|
Show InChI InChI=1S/C21H13FN2O4/c1-24-8-14(13-6-10(22)2-5-16(13)24)18-19(21(27)23-20(18)26)15-9-28-17-7-11(25)3-4-12(15)17/h2-9,25H,1H3,(H,23,26,27)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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DrugBank
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.5n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human GSK3-beta by scintillation counting


J Med Chem 52: 1853-63 (2009)


Article DOI: 10.1021/jm801317h
BindingDB Entry DOI: 10.7270/Q24M94FZ
More data for this
Ligand-Target Pair