BDBM50479451 CHEMBL460946

SMILES: CC(C)[C@H](CO)Nc1nc(NCc2ccc(cc2)-c2ccccn2)c2ncn(C(C)C)c2n1

InChI Key: InChIKey=KORMOHIBSWURFV-NRFANRHFSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50479451   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Glycogen synthase kinase-3 (Sus scrofa)	BDBM50479451 (CHEMBL460946) Show SMILES CC(C)[C@H](CO)Nc1nc(NCc2ccc(cc2)-c2ccccn2)c2ncn(C(C)C)c2n1 |r| Show InChI InChI=1S/C25H31N7O/c1-16(2)21(14-33)29-25-30-23(22-24(31-25)32(15-28-22)17(3)4)27-13-18-8-10-19(11-9-18)20-7-5-6-12-26-20/h5-12,15-17,21,33H,13-14H2,1-4H3,(H2,27,29,30,31)/t21-/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universite Paris-Descartes Curated by ChEMBL					Assay Description Inhibition of pig brain GSK3alpha/beta				J Med Chem 51: 5229-42 (2008) Article DOI: 10.1021/jm800109e BindingDB Entry DOI: 10.7270/Q2DB84PF
					More data for this Ligand-Target Pair