BDBM50347934 CHEMBL1802638

SMILES: CNC(=O)c1ccc(OC)c(c1)-n1c(C)cc(OCc2ccc(F)cc2F)c(Br)c1=O

InChI Key: InChIKey=DJOXBSFRPYOUFS-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 = 50347934   

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))	BDBM50347934 (CHEMBL1802638) Show SMILES CNC(=O)c1ccc(OC)c(c1)-n1c(C)cc(OCc2ccc(F)cc2F)c(Br)c1=O |(2.35,-36.25,;2.32,-34.71,;3.63,-33.91,;4.98,-34.65,;3.6,-32.37,;4.94,-31.6,;4.93,-30.05,;3.59,-29.29,;3.59,-27.75,;4.91,-26.97,;2.28,-30.06,;2.27,-31.6,;.94,-29.29,;.93,-27.74,;2.27,-26.97,;-.4,-26.98,;-1.73,-27.75,;-3.06,-26.98,;-4.4,-27.75,;-5.73,-26.98,;-7.05,-27.75,;-8.39,-26.99,;-8.39,-25.44,;-9.73,-24.67,;-7.06,-24.67,;-5.72,-25.44,;-4.39,-24.67,;-1.73,-29.3,;-3.07,-30.06,;-.4,-30.07,;-.4,-31.61,)| Show InChI InChI=1S/C22H19BrF2N2O4/c1-12-8-19(31-11-14-4-6-15(24)10-16(14)25)20(23)22(29)27(12)17-9-13(21(28)26-2)5-7-18(17)30-3/h4-10H,11H2,1-3H3,(H,26,28)	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	21	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of p38alpha assessed as phosphorylation FITC-labeled Hsp27 after 60 mins by fluorescence based cascade assay				Bioorg Med Chem Lett 21: 4066-71 (2011) Article DOI: 10.1016/j.bmcl.2011.04.121 BindingDB Entry DOI: 10.7270/Q2SB46R2
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