BDBM50524529 CHEMBL4476843

SMILES: Fc1ccc(cc1)-c1nc([nH]c1-c1ccnc(NC(=O)C2CC2)c1)-c1ccco1

InChI Key: InChIKey=WSBSGWDWALJLJA-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 = 50524529   

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))	BDBM50524529 (CHEMBL4476843) Show SMILES Fc1ccc(cc1)-c1nc([nH]c1-c1ccnc(NC(=O)C2CC2)c1)-c1ccco1 Show InChI InChI=1S/C22H17FN4O2/c23-16-7-5-13(6-8-16)19-20(27-21(26-19)17-2-1-11-29-17)15-9-10-24-18(12-15)25-22(28)14-3-4-14/h1-2,5-12,14H,3-4H2,(H,26,27)(H,24,25,28)	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	156	n/a	n/a	n/a	n/a	n/a	n/a
Eberhard Karls Universit£t T£bingen Curated by ChEMBL					Assay Description Competitive inhibition of human recombinant full length GSK3beta using YRRAAVPPSPSLSRHSSPHQ(pS)EDEEE as substrate preincubated with enzyme for 10 min...				Eur J Med Chem 175: 309-329 (2019) Article DOI: 10.1016/j.ejmech.2019.04.035
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50524529 (CHEMBL4476843) Show SMILES Fc1ccc(cc1)-c1nc([nH]c1-c1ccnc(NC(=O)C2CC2)c1)-c1ccco1 Show InChI InChI=1S/C22H17FN4O2/c23-16-7-5-13(6-8-16)19-20(27-21(26-19)17-2-1-11-29-17)15-9-10-24-18(12-15)25-22(28)14-3-4-14/h1-2,5-12,14H,3-4H2,(H,26,27)(H,24,25,28)	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	18	n/a	n/a	n/a	n/a	n/a	n/a
Eberhard Karls Universit£t T£bingen Curated by ChEMBL					Assay Description Inhibition of p38alpha MAPK (unknown origin) using ATF-2 as substrate after 1 hr by ELISA				Eur J Med Chem 175: 309-329 (2019) Article DOI: 10.1016/j.ejmech.2019.04.035
					More data for this Ligand-Target Pair