BDBM50269481 CHEMBL4082385

SMILES: Cl.COc1cc(F)ccc1C1CN(CCN1C)c1nc(cc(=O)n1C)-c1ccncc1

InChI Key: InChIKey=LTJCYZIHWLGQMW-UHFFFAOYSA-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 = 50269481   

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 beta (Homo sapiens (Human))	BDBM50269481 (CHEMBL4082385) Show SMILES Cl.COc1cc(F)ccc1C1CN(CCN1C)c1nc(cc(=O)n1C)-c1ccncc1 Show InChI InChI=1S/C22H24FN5O2.ClH/c1-26-10-11-28(14-19(26)17-5-4-16(23)12-20(17)30-3)22-25-18(13-21(29)27(22)2)15-6-8-24-9-7-15;/h4-9,12-13,19H,10-11,14H2,1-3H3;1H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	56	n/a	n/a	n/a	n/a	n/a	n/a
Sohyaku, Innovative Research Division, Mitsubishi Tanabe Pharma Corporation, 1000 Kamoshida-cho, Aoba-ku, Yokohama 227-0033, Japan. Curated by ChEMBL					Assay Description Inhibition of recombinant human GSK-3beta using prephosphorylated GS-1 peptide as substrate after 1 hr in presence of [gamma-32P]ATP by liquid scinti...				Bioorg Med Chem Lett 27: 3726-3732 (2017) Article DOI: 10.1016/j.bmcl.2017.06.078 BindingDB Entry DOI: 10.7270/Q2T43WKZ
					More data for this Ligand-Target Pair