Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glycogen synthase kinase-3 beta' and Ligand = 'BDBM189396'   

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))	BDBM189396 (3-((1-(4-nitrophenyl)-1H-1,2,3-triazol-4-yl)methyl...) Show SMILES [O-][N+](=O)c1ccc(cc1)-n1cc(Cn2c3ncccc3oc2=O)nn1 Show InChI InChI=1S/C15H10N6O4/c22-15-19(14-13(25-15)2-1-7-16-14)8-10-9-20(18-17-10)11-3-5-12(6-4-11)21(23)24/h1-7,9H,8H2	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	1.71E+4	n/a	n/a	n/a	n/a	n/a	30
Hamdard University (Jamia Hamdard)					Assay Description In a typical assay, 10 µL of test compound of different concentrations (dissolvedin dimethyl sulfoxide [DMSO] and diluted with assay buffer) and 10 µ...				Chem Biol Drug Des 87: 918-26 (2016) Article DOI: 10.1111/cbdd.12724 BindingDB Entry DOI: 10.7270/Q28914NR
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