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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 = 'BDBM50523812'   
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))
BDBM50523812
PNG
(CHEMBL4448193)
Show SMILES O=C1Nc2ccccc2C1=Cc1ccncc1
Show InChI InChI=1S/C14H10N2O/c17-14-12(9-10-5-7-15-8-6-10)11-3-1-2-4-13(11)16-14/h1-9H,(H,16,17)/b12-9-
PDB
MMDB

NCI pathway
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KEGG

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Lomonosov Moscow State University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GSK3beta using YRRAAVPPSPSLSRHSSPHQ(pS)EDEEE as substrate measured after 60 mins by ADP-Glo luminescence assay


Bioorg Med Chem 27: 1804-1817 (2019)


Article DOI: 10.1016/j.bmc.2019.03.028
BindingDB Entry DOI: 10.7270/Q24X5C7R
More data for this
Ligand-Target Pair