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SMILES: CCCCc1nc(cc(=O)[nH]1)-c1ccncc1

InChI Key: InChIKey=XKFAKPKBVZBZRX-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50494523   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM50494523
PNG
(CHEMBL3093036)
Show SMILES CCCCc1nc(cc(=O)[nH]1)-c1ccncc1
Show InChI InChI=1S/C13H15N3O/c1-2-3-4-12-15-11(9-13(17)16-12)10-5-7-14-8-6-10/h5-9H,2-4H2,1H3,(H,15,16,17)
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

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DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.30E+3n/an/an/an/an/an/a



Mitsubishi Tanabe Pharma Corporation

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GSK3beta using prephosphorylated GS1 peptide as substrate after 1 hr by liquid scintillation spectrometry


Bioorg Med Chem Lett 23: 6928-32 (2013)


Article DOI: 10.1016/j.bmcl.2013.09.021
BindingDB Entry DOI: 10.7270/Q2736TV7
More data for this
Ligand-Target Pair