Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glycogen synthase kinase-3 beta' and Ligand = 'BDBM50332533'   

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))	BDBM50332533 ((Z)-3,3'-(4-((4-oxo-2-thioxothiazolidin-5-ylidene)...) Show SMILES OC(=O)CCN(CCC(O)=O)c1ccc(C=C2SC(S)=NC2=O)cc1 |w:15.14,c:19| Show InChI InChI=1S/C16H16N2O5S2/c19-13(20)5-7-18(8-6-14(21)22)11-3-1-10(2-4-11)9-12-15(23)17-16(24)25-12/h1-4,9H,5-8H2,(H,19,20)(H,21,22)(H,17,23,24)	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	263	n/a	n/a	n/a	n/a	n/a	n/a
University of Louisiana at Monroe Curated by ChEMBL					Assay Description Inhibition of recombinant GSK3beta Z'-LYTE kinase assay kit method				J Med Chem 53: 8534-45 (2010) Article DOI: 10.1021/jm100941j BindingDB Entry DOI: 10.7270/Q2DB8230
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