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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 = 'BDBM50389093'   
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))
BDBM50389093
PNG
(CHEMBL2064522)
Show SMILES C(Sc1nnc(o1)-c1ccc2OCOc2c1)c1ccc(cc1)-c1nnn[nH]1
Show InChI InChI=1S/C17H12N6O3S/c1-3-11(15-18-22-23-19-15)4-2-10(1)8-27-17-21-20-16(26-17)12-5-6-13-14(7-12)25-9-24-13/h1-7H,8-9H2,(H,18,19,22,23)
PDB
MMDB

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UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 172n/an/an/an/an/an/a



Technische Universit£t Darmstadt

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GSK3beta using pIRS-1 as substrate preincubated for 15 mins


J Med Chem 55: 4407-24 (2012)


Article DOI: 10.1021/jm300309a
BindingDB Entry DOI: 10.7270/Q2MG7QK0
More data for this
Ligand-Target Pair