Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glycogen synthase kinase-3 alpha' and Ligand = 'BDBM381126'   

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 alpha (Homo sapiens (Human))	BDBM381126 (3-((4-((4-(3-(3-(2-Amino-2-oxoethyl)-5-(tert-butyl...) Show SMILES COc1cc(Nc2cc(Oc3ccc(NC(=O)Nc4cc(cc(CC(N)=O)c4OC)C(C)(C)C)c4ccccc34)ccn2)cc(c1)C(=O)NCCN1CCOCC1 Show InChI InChI=1S/C43H49N7O7/c1-43(2,3)29-20-27(23-38(44)51)40(55-5)36(24-29)49-42(53)48-35-10-11-37(34-9-7-6-8-33(34)35)57-31-12-13-45-39(26-31)47-30-21-28(22-32(25-30)54-4)41(52)46-14-15-50-16-18-56-19-17-50/h6-13,20-22,24-26H,14-19,23H2,1-5H3,(H2,44,51)(H,45,47)(H,46,52)(H2,48,49,53)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Cephalon					Assay Description Method 1: The inhibitory activities of compounds of the invention against the GSK 3α enzyme isoform (Invitrogen), are evaluated by determining ...				J Med Chem 51: 5680-9 (2008) BindingDB Entry DOI: 10.7270/Q2FB558N
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