BDBM50133388 CHEMBL3632824

SMILES: NC(=O)c1cc(F)ccc1-c1ccc(CSc2nnc(o2)-c2ccc3OCCOc3c2)cc1

InChI Key: InChIKey=KRLXYVKWKDSKSA-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50133388   

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 alpha (Homo sapiens (Human))	BDBM50133388 (CHEMBL3632824) Show SMILES NC(=O)c1cc(F)ccc1-c1ccc(CSc2nnc(o2)-c2ccc3OCCOc3c2)cc1 Show InChI InChI=1S/C24H18FN3O4S/c25-17-6-7-18(19(12-17)22(26)29)15-3-1-14(2-4-15)13-33-24-28-27-23(32-24)16-5-8-20-21(11-16)31-10-9-30-20/h1-8,11-12H,9-10,13H2,(H2,26,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Inhibition of human recombinant GSK-3 alpha using Ulight-CFFKNIVTPRTPPPSQGK-amide substrate incubated for 60 mins by LANCE method relative to control				J Med Chem 58: 8907-19 (2015) BindingDB Entry DOI: 10.7270/Q2K64KW5
					More data for this Ligand-Target Pair
Glycogen synthase kinase-3 beta (Homo sapiens (Human))	BDBM50133388 (CHEMBL3632824) Show SMILES NC(=O)c1cc(F)ccc1-c1ccc(CSc2nnc(o2)-c2ccc3OCCOc3c2)cc1 Show InChI InChI=1S/C24H18FN3O4S/c25-17-6-7-18(19(12-17)22(26)29)15-3-1-14(2-4-15)13-33-24-28-27-23(32-24)16-5-8-20-21(11-16)31-10-9-30-20/h1-8,11-12H,9-10,13H2,(H2,26,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Inhibition of human recombinant GSK-3 beta using Ulight-CFFKNIVTPRTPPPSQGK-amide substrate incubated for 90 mins by LANCE method relative to control				J Med Chem 58: 8907-19 (2015) BindingDB Entry DOI: 10.7270/Q2K64KW5
					More data for this Ligand-Target Pair