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SMILES: Cn1n(-c2ccccc2)c2nc(Nc3ccc(cc3)C(O)=O)ncc2c1=O

InChI Key: InChIKey=VXPGSWUSBILLRA-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50377260   
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))
BDBM50377260
PNG
(CHEMBL401918)
Show SMILES Cn1n(-c2ccccc2)c2nc(Nc3ccc(cc3)C(O)=O)ncc2c1=O
Show InChI InChI=1S/C19H15N5O3/c1-23-17(25)15-11-20-19(21-13-9-7-12(8-10-13)18(26)27)22-16(15)24(23)14-5-3-2-4-6-14/h2-11H,1H3,(H,26,27)(H,20,21,22)
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 960n/an/an/an/an/an/a



Kemia, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta


Bioorg Med Chem Lett 18: 3578-81 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.001
BindingDB Entry DOI: 10.7270/Q2571CXM
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3 alpha


(Homo sapiens (Human))
BDBM50377260
PNG
(CHEMBL401918)
Show SMILES Cn1n(-c2ccccc2)c2nc(Nc3ccc(cc3)C(O)=O)ncc2c1=O
Show InChI InChI=1S/C19H15N5O3/c1-23-17(25)15-11-20-19(21-13-9-7-12(8-10-13)18(26)27)22-16(15)24(23)14-5-3-2-4-6-14/h2-11H,1H3,(H,26,27)(H,20,21,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.02E+3n/an/an/an/an/an/a



Kemia, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GSK3alpha


Bioorg Med Chem Lett 18: 3578-81 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.001
BindingDB Entry DOI: 10.7270/Q2571CXM
More data for this
Ligand-Target Pair