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BDBM50377254 CHEMBL256307

SMILES: OC(=O)c1ccc(Nc2ncc(F)c(Nc3ccccc3)n2)cc1

InChI Key: InChIKey=OZSYMOFAQHDNQJ-UHFFFAOYSA-N

Data: 2 IC50

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 = 50377254   
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


(Homo sapiens (Human))
BDBM50377254
PNG
(CHEMBL256307)
Show SMILES OC(=O)c1ccc(Nc2ncc(F)c(Nc3ccccc3)n2)cc1
Show InChI InChI=1S/C17H13FN4O2/c18-14-10-19-17(21-13-8-6-11(7-9-13)16(23)24)22-15(14)20-12-4-2-1-3-5-12/h1-10H,(H,23,24)(H2,19,20,21,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.76E+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
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM50377254
PNG
(CHEMBL256307)
Show SMILES OC(=O)c1ccc(Nc2ncc(F)c(Nc3ccccc3)n2)cc1
Show InChI InChI=1S/C17H13FN4O2/c18-14-10-19-17(21-13-8-6-11(7-9-13)16(23)24)22-15(14)20-12-4-2-1-3-5-12/h1-10H,(H,23,24)(H2,19,20,21,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.17E+3n/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