Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glycogen synthase kinase-3 beta' and Ligand = 'BDBM50190182'   

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))	BDBM50190182 (CHEMBL3828397) Show SMILES CCCCNc1nnc(Cn2c(C)nc3ccccc23)s1 Show InChI InChI=1S/C15H19N5S/c1-3-4-9-16-15-19-18-14(21-15)10-20-11(2)17-12-7-5-6-8-13(12)20/h5-8H,3-4,9-10H2,1-2H3,(H,16,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	582	n/a	n/a	n/a	n/a	n/a	n/a
Jamia Hamdard (Hamdard University) Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal His-tagged GSK-3beta expressed in Escherichia coli using glycogen synthase-2 as substrate and ATP measured...				Bioorg Med Chem Lett 26: 4020-4 (2016) Article DOI: 10.1016/j.bmcl.2016.06.084 BindingDB Entry DOI: 10.7270/Q2639RP0
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