Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 14' and Ligand = 'BDBM50175746'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/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))	BDBM50175746 (7-(1-tert-butylpiperidin-4-yloxy)-5-(2,4-difluorop...) Show SMILES CC(C)(C)N1CCC(CC1)Oc1cc(-c2ccc(F)cc2F)c2ccc(=O)n(-c3c(F)cccc3F)c2c1 |(32.39,-2.03,;31.06,-1.27,;30.29,-2.6,;31.84,.06,;29.73,-.5,;28.39,-1.26,;27.06,-.5,;27.05,1.04,;28.39,1.82,;29.73,1.05,;25.72,1.81,;24.39,1.03,;24.39,-.52,;23.06,-1.29,;23.06,-2.82,;21.72,-3.59,;21.72,-5.13,;23.06,-5.9,;23.06,-7.44,;24.39,-5.12,;24.39,-3.59,;25.72,-2.82,;21.72,-.52,;20.39,-1.29,;19.05,-.52,;19.05,1.03,;17.72,1.8,;20.39,1.79,;20.39,3.33,;19.06,4.09,;17.73,3.32,;19.06,5.63,;20.4,6.41,;21.73,5.63,;21.73,4.09,;23.06,3.32,;21.72,1.03,;23.05,1.8,)| Show InChI InChI=1S/C30H28F4N2O2/c1-30(2,3)35-13-11-19(12-14-35)38-20-16-23(21-8-7-18(31)15-26(21)34)22-9-10-28(37)36(27(22)17-20)29-24(32)5-4-6-25(29)33/h4-10,15-17,19H,11-14H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20	n/a	n/a	n/a	n/a	n/a	n/a
Merck & Co. Curated by ChEMBL					Assay Description Inhibition of TNF alpha release in THP1 cells				Bioorg Med Chem Lett 16: 64-8 (2005) Article DOI: 10.1016/j.bmcl.2005.09.065 BindingDB Entry DOI: 10.7270/Q2TT4QH8
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50175746 (7-(1-tert-butylpiperidin-4-yloxy)-5-(2,4-difluorop...) Show SMILES CC(C)(C)N1CCC(CC1)Oc1cc(-c2ccc(F)cc2F)c2ccc(=O)n(-c3c(F)cccc3F)c2c1 |(32.39,-2.03,;31.06,-1.27,;30.29,-2.6,;31.84,.06,;29.73,-.5,;28.39,-1.26,;27.06,-.5,;27.05,1.04,;28.39,1.82,;29.73,1.05,;25.72,1.81,;24.39,1.03,;24.39,-.52,;23.06,-1.29,;23.06,-2.82,;21.72,-3.59,;21.72,-5.13,;23.06,-5.9,;23.06,-7.44,;24.39,-5.12,;24.39,-3.59,;25.72,-2.82,;21.72,-.52,;20.39,-1.29,;19.05,-.52,;19.05,1.03,;17.72,1.8,;20.39,1.79,;20.39,3.33,;19.06,4.09,;17.73,3.32,;19.06,5.63,;20.4,6.41,;21.73,5.63,;21.73,4.09,;23.06,3.32,;21.72,1.03,;23.05,1.8,)| Show InChI InChI=1S/C30H28F4N2O2/c1-30(2,3)35-13-11-19(12-14-35)38-20-16-23(21-8-7-18(31)15-26(21)34)22-9-10-28(37)36(27(22)17-20)29-24(32)5-4-6-25(29)33/h4-10,15-17,19H,11-14H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10.5	n/a	n/a	n/a	n/a	n/a	n/a
Merck & Co. Curated by ChEMBL					Assay Description Inhibition of P38 alpha MAPK				Bioorg Med Chem Lett 16: 64-8 (2005) Article DOI: 10.1016/j.bmcl.2005.09.065 BindingDB Entry DOI: 10.7270/Q2TT4QH8
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50175746 (7-(1-tert-butylpiperidin-4-yloxy)-5-(2,4-difluorop...) Show SMILES CC(C)(C)N1CCC(CC1)Oc1cc(-c2ccc(F)cc2F)c2ccc(=O)n(-c3c(F)cccc3F)c2c1 |(32.39,-2.03,;31.06,-1.27,;30.29,-2.6,;31.84,.06,;29.73,-.5,;28.39,-1.26,;27.06,-.5,;27.05,1.04,;28.39,1.82,;29.73,1.05,;25.72,1.81,;24.39,1.03,;24.39,-.52,;23.06,-1.29,;23.06,-2.82,;21.72,-3.59,;21.72,-5.13,;23.06,-5.9,;23.06,-7.44,;24.39,-5.12,;24.39,-3.59,;25.72,-2.82,;21.72,-.52,;20.39,-1.29,;19.05,-.52,;19.05,1.03,;17.72,1.8,;20.39,1.79,;20.39,3.33,;19.06,4.09,;17.73,3.32,;19.06,5.63,;20.4,6.41,;21.73,5.63,;21.73,4.09,;23.06,3.32,;21.72,1.03,;23.05,1.8,)| Show InChI InChI=1S/C30H28F4N2O2/c1-30(2,3)35-13-11-19(12-14-35)38-20-16-23(21-8-7-18(31)15-26(21)34)22-9-10-28(37)36(27(22)17-20)29-24(32)5-4-6-25(29)33/h4-10,15-17,19H,11-14H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	18.4	n/a	n/a	n/a	n/a	n/a	n/a
Merck & Co. Curated by ChEMBL					Assay Description Inhibition of LPS stimulated TNF alpha release in whole blood				Bioorg Med Chem Lett 16: 64-8 (2005) Article DOI: 10.1016/j.bmcl.2005.09.065 BindingDB Entry DOI: 10.7270/Q2TT4QH8
					More data for this Ligand-Target Pair