BDBM50122409 1-(2,6-Dichloro-phenyl)-5-(2-fluoro-phenyl)-2-oxo-1,2,3,4-tetrahydro-quinazoline-7-carboxylic acid methyl ester::CHEMBL94495::methyl 1-(2,6-dichlorophenyl)-5-(2-fluorophenyl)-2-oxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate

SMILES: COC(=O)c1cc2N(C(=O)NCc2c(c1)-c1ccccc1F)c1c(Cl)cccc1Cl

InChI Key: InChIKey=CKHXIJJHJJBNBX-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50122409   

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))	BDBM50122409 (1-(2,6-Dichloro-phenyl)-5-(2-fluoro-phenyl)-2-oxo-...) Show SMILES COC(=O)c1cc2N(C(=O)NCc2c(c1)-c1ccccc1F)c1c(Cl)cccc1Cl Show InChI InChI=1S/C22H15Cl2FN2O3/c1-30-21(28)12-9-14(13-5-2-3-8-18(13)25)15-11-26-22(29)27(19(15)10-12)20-16(23)6-4-7-17(20)24/h2-10H,11H2,1H3,(H,26,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibitory activity against mitogen-activated protein kinase p38 alpha				Bioorg Med Chem Lett 13: 277-80 (2002) BindingDB Entry DOI: 10.7270/Q25X2884
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50122409 (1-(2,6-Dichloro-phenyl)-5-(2-fluoro-phenyl)-2-oxo-...) Show SMILES COC(=O)c1cc2N(C(=O)NCc2c(c1)-c1ccccc1F)c1c(Cl)cccc1Cl Show InChI InChI=1S/C22H15Cl2FN2O3/c1-30-21(28)12-9-14(13-5-2-3-8-18(13)25)15-11-26-22(29)27(19(15)10-12)20-16(23)6-4-7-17(20)24/h2-10H,11H2,1H3,(H,26,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p38alpha MAPK (unknown origin)				Citation and Details Article DOI: 10.1007/s00044-012-0179-7 BindingDB Entry DOI: 10.7270/Q2WW7MMT
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50122409 (1-(2,6-Dichloro-phenyl)-5-(2-fluoro-phenyl)-2-oxo-...) Show SMILES COC(=O)c1cc2N(C(=O)NCc2c(c1)-c1ccccc1F)c1c(Cl)cccc1Cl Show InChI InChI=1S/C22H15Cl2FN2O3/c1-30-21(28)12-9-14(13-5-2-3-8-18(13)25)15-11-26-22(29)27(19(15)10-12)20-16(23)6-4-7-17(20)24/h2-10H,11H2,1H3,(H,26,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
University of Zurich Curated by ChEMBL					Assay Description Inhibition of p38alpha				J Med Chem 51: 1179-88 (2008) Article DOI: 10.1021/jm070654j BindingDB Entry DOI: 10.7270/Q29Z95RD
					More data for this Ligand-Target Pair