BDBM50347935 CHEMBL1802639

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

InChI Key: InChIKey=ZBAWNBSFOKRECZ-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 = 50347935   

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))	BDBM50347935 (CHEMBL1802639) Show SMILES CNC(=O)c1ccc(C(O)=O)c(c1)-n1c(C)cc(OCc2ccc(F)cc2F)c(Br)c1=O |(20.52,-39.27,;20.49,-37.73,;21.8,-36.93,;23.15,-37.67,;21.77,-35.4,;23.1,-34.62,;23.1,-33.08,;21.76,-32.32,;21.75,-30.77,;23.08,-29.99,;20.41,-30.01,;20.44,-33.09,;20.44,-34.63,;19.11,-32.32,;19.1,-30.77,;19.09,-29.23,;17.77,-30.01,;16.44,-30.78,;15.11,-30.01,;13.77,-30.78,;12.44,-30.01,;11.12,-30.78,;9.78,-30.02,;9.78,-28.47,;8.44,-27.7,;11.11,-27.7,;12.44,-28.47,;13.78,-27.7,;16.44,-32.32,;15.1,-33.09,;17.77,-33.09,;17.77,-34.63,)| Show InChI InChI=1S/C22H17BrF2N2O5/c1-11-7-18(32-10-13-3-5-14(24)9-16(13)25)19(23)21(29)27(11)17-8-12(20(28)26-2)4-6-15(17)22(30)31/h3-9H,10H2,1-2H3,(H,26,28)(H,30,31)	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	>1.00E+4	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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