Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glycogen synthase kinase-3 beta' and Ligand = 'BDBM8696'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Glycogen synthase kinase-3 beta (Homo sapiens (Human))	BDBM8696 (N-{4-[(1E)-{2-[1-(3-methoxyphenyl)-1H-pyrazolo[3,4...) Show SMILES COc1cccc(c1)-n1ncc2c(N=NCc3ccc(NC(C)=O)cc3)ncnc12 |w:13.13| Show InChI InChI=1S/C21H19N7O2/c1-14(29)26-16-8-6-15(7-9-16)11-24-27-20-19-12-25-28(21(19)23-13-22-20)17-4-3-5-18(10-17)30-2/h3-10,12-13H,11H2,1-2H3,(H,26,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	12.6	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline					Assay Description The biochemical activity of compounds was determined by incubation with specific enzyme and substrate in the presence 2.5 uM ATP/ [gamma-33P] ATP. Af...				Bioorg Med Chem Lett 14: 2121-5 (2004) Article DOI: 10.1016/j.bmcl.2004.02.036 BindingDB Entry DOI: 10.7270/Q2NV9GF5
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