BDBM50253907 3-(4-(4-Fluorophenyl)-5-(2-(tetrahydro-2H-pyran-4-ylamino)pyridin-4-yl)-1H-imidazol-2-ylthio)propane-1,2-diol::CHEMBL459926

SMILES: OCC(O)CSc1nc(c([nH]1)-c1ccc(F)cc1)-c1ccnc(NC2CCOCC2)c1

InChI Key: InChIKey=HQVRTEVEFWPWCH-UHFFFAOYSA-N

Data: 1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50253907   

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
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50253907 (3-(4-(4-Fluorophenyl)-5-(2-(tetrahydro-2H-pyran-4-...) Show SMILES OCC(O)CSc1nc(c([nH]1)-c1ccc(F)cc1)-c1ccnc(NC2CCOCC2)c1 Show InChI InChI=1S/C22H25FN4O3S/c23-16-3-1-14(2-4-16)20-21(27-22(26-20)31-13-18(29)12-28)15-5-8-24-19(11-15)25-17-6-9-30-10-7-17/h1-5,8,11,17-18,28-29H,6-7,9-10,12-13H2,(H,24,25)(H,26,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Eberhard-Karls University of Tübingen Curated by ChEMBL					Assay Description Inhibition of p38alpha (unknown origin)				J Med Chem 51: 5630-40 (2008) Article DOI: 10.1021/jm800373t BindingDB Entry DOI: 10.7270/Q2XS5V6V
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