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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 = 'BDBM50220370'   
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))
BDBM50220370
PNG
(3-(1-methylindol-3-yl)-4-[3-(2-aminoethoxy)phenyl]...)
Show SMILES Cn1cc(C2=C(C(=O)NC2=O)c2cccc(OCCN)c2)c2ccccc12 |t:4|
Show InChI InChI=1S/C21H19N3O3/c1-24-12-16(15-7-2-3-8-17(15)24)19-18(20(25)23-21(19)26)13-5-4-6-14(11-13)27-10-9-22/h2-8,11-12H,9-10,22H2,1H3,(H,23,25,26)
PDB
MMDB

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Similars

Article
PubMed
n/an/a 70n/an/an/an/an/an/a



CrystalGenomics, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GSK3beta at 5 uM


Bioorg Med Chem Lett 17: 5686-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.056
BindingDB Entry DOI: 10.7270/Q2HH6JT3
More data for this
Ligand-Target Pair