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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 = 'BDBM50523832'   
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))
BDBM50523832
PNG
(CHEMBL4465183)
Show SMILES [O-][N+](=O)c1ccc2NC(=O)\C(=C\c3ccccn3)c2c1
Show InChI InChI=1S/C14H9N3O3/c18-14-12(7-9-3-1-2-6-15-9)11-8-10(17(19)20)4-5-13(11)16-14/h1-8H,(H,16,18)/b12-7+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.00E+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