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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Glycogen synthase kinase-3 beta' and Ligand = 'BDBM8574'   
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))
BDBM8574
PNG
(4-Acylamino-6-arylfuro[2,3-d]pyrimidine 19 | N-[6-...)
Show SMILES O=C(Nc1ncnc2oc(cc12)-c1cccnc1)C1CC1
Show InChI InChI=1S/C15H12N4O2/c20-14(9-3-4-9)19-13-11-6-12(10-2-1-5-16-7-10)21-15(11)18-8-17-13/h1-2,5-9H,3-4H2,(H,17,18,19,20)
PDB
MMDB

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Similars

Article
PubMed
n/an/a 5n/an/an/an/an/an/a



Wuhan Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of human Protein kinase C beta 2


Eur J Med Chem 164: 448-470 (2019)


Article DOI: 10.1016/j.ejmech.2018.12.073
BindingDB Entry DOI: 10.7270/Q2WH2SVB
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM8574
PNG
(4-Acylamino-6-arylfuro[2,3-d]pyrimidine 19 | N-[6-...)
Show SMILES O=C(Nc1ncnc2oc(cc12)-c1cccnc1)C1CC1
Show InChI InChI=1S/C15H12N4O2/c20-14(9-3-4-9)19-13-11-6-12(10-2-1-5-16-7-10)21-15(11)18-8-17-13/h1-2,5-9H,3-4H2,(H,17,18,19,20)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents


Similars

Article
PubMed
n/an/a 5n/an/an/an/a7.222



Tsukuba Research Laboratories



Assay Description
The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-32P] ATP. Af...


Bioorg Med Chem Lett 14: 3907-11 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.064
BindingDB Entry DOI: 10.7270/Q2XD0ZWC
More data for this
Ligand-Target Pair