Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glycogen synthase kinase-3 beta' and Ligand = 'BDBM50469295'   

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))	BDBM50469295 (CHEMBL4282621) Show SMILES CCCCNC(=O)c1ccc(cc1)C1CC(=O)N(Cc2ccccc2[N+]([O-])=O)c2ccccc2S1 Show InChI InChI=1S/C27H27N3O4S/c1-2-3-16-28-27(32)20-14-12-19(13-15-20)25-17-26(31)29(23-10-6-7-11-24(23)35-25)18-21-8-4-5-9-22(21)30(33)34/h4-15,25H,2-3,16-18H2,1H3,(H,28,32)	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	2.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Inhibition of human recombinant N-terminal His6-tagged human GSK-3beta expressed in Baculovirus infected SF9 cells using prephosphorylated-GS2 polype...				Bioorg Med Chem 26: 5479-5493 (2018) Article DOI: 10.1016/j.bmc.2018.09.027 BindingDB Entry DOI: 10.7270/Q2319ZMZ
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