BDBM50421129 CHEMBL2088584

SMILES: CCCNC(=O)c1ccc(F)c(c1)-c1c2ccc(Oc3ccc(F)cc3F)nn2ccc1=O

InChI Key: InChIKey=CAABEMBPTVKPLJ-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 = 50421129   

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
MAP kinase p38 beta (Mus musculus (mouse))	BDBM50421129 (CHEMBL2088584) Show SMILES CCCNC(=O)c1ccc(F)c(c1)-c1c2ccc(Oc3ccc(F)cc3F)nn2ccc1=O |(11.3,-12.29,;9.97,-13.06,;8.64,-12.3,;7.3,-13.07,;5.97,-12.31,;5.96,-10.77,;4.64,-13.08,;3.3,-12.32,;1.97,-13.09,;1.97,-14.63,;.64,-15.4,;3.31,-15.41,;4.64,-14.63,;3.31,-16.94,;4.64,-17.71,;5.95,-16.94,;7.28,-17.69,;7.29,-19.23,;8.63,-20,;8.63,-21.54,;7.3,-22.31,;7.3,-23.85,;8.64,-24.61,;8.65,-26.15,;9.98,-23.83,;9.96,-22.3,;11.29,-21.52,;5.96,-20,;4.64,-19.24,;3.3,-20.02,;1.97,-19.25,;1.97,-17.71,;.64,-16.94,)| Show InChI InChI=1S/C24H18F3N3O3/c1-2-10-28-24(32)14-3-5-17(26)16(12-14)23-19-6-8-22(29-30(19)11-9-20(23)31)33-21-7-4-15(25)13-18(21)27/h3-9,11-13H,2,10H2,1H3,(H,28,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of mouse p38beta assessed as reduction in GST-ATF2 substrate phosphorylation by SPA assay				Bioorg Med Chem Lett 22: 5979-83 (2012) Article DOI: 10.1016/j.bmcl.2012.07.035 BindingDB Entry DOI: 10.7270/Q28P61S0
					More data for this Ligand-Target Pair
MAP kinase p38 (Mus musculus (mouse))	BDBM50421129 (CHEMBL2088584) Show SMILES CCCNC(=O)c1ccc(F)c(c1)-c1c2ccc(Oc3ccc(F)cc3F)nn2ccc1=O |(11.3,-12.29,;9.97,-13.06,;8.64,-12.3,;7.3,-13.07,;5.97,-12.31,;5.96,-10.77,;4.64,-13.08,;3.3,-12.32,;1.97,-13.09,;1.97,-14.63,;.64,-15.4,;3.31,-15.41,;4.64,-14.63,;3.31,-16.94,;4.64,-17.71,;5.95,-16.94,;7.28,-17.69,;7.29,-19.23,;8.63,-20,;8.63,-21.54,;7.3,-22.31,;7.3,-23.85,;8.64,-24.61,;8.65,-26.15,;9.98,-23.83,;9.96,-22.3,;11.29,-21.52,;5.96,-20,;4.64,-19.24,;3.3,-20.02,;1.97,-19.25,;1.97,-17.71,;.64,-16.94,)| Show InChI InChI=1S/C24H18F3N3O3/c1-2-10-28-24(32)14-3-5-17(26)16(12-14)23-19-6-8-22(29-30(19)11-9-20(23)31)33-21-7-4-15(25)13-18(21)27/h3-9,11-13H,2,10H2,1H3,(H,28,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of mouse p38apha assessed as reduction in GST-ATF2 substrate phosphorylation by SPA assay				Bioorg Med Chem Lett 22: 5979-83 (2012) Article DOI: 10.1016/j.bmcl.2012.07.035 BindingDB Entry DOI: 10.7270/Q28P61S0
					More data for this Ligand-Target Pair