Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glycogen synthase kinase-3 beta' and Ligand = 'BDBM8540'   

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))	BDBM8540 (4-[(1E)-{2-[3-(3-methoxyphenyl)-1H-pyrazolo[4,3-d]...) Show SMILES COc1cccc(c1)-c1n[nH]c2c(N=NCc3ccncc3)ncnc12 |w:13.13| Show InChI InChI=1S/C18H15N7O/c1-26-14-4-2-3-13(9-14)15-16-17(24-23-15)18(21-11-20-16)25-22-10-12-5-7-19-8-6-12/h2-9,11H,10H2,1H3,(H,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.01	n/a	n/a	n/a	n/a	7.2	22
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 16: 2091-4 (2006) Article DOI: 10.1016/j.bmcl.2006.01.057 BindingDB Entry DOI: 10.7270/Q25X274X
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