Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 14' and Ligand = 'BDBM50303227'   

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))	BDBM50303227 (6-(2,6-dichlorophenyl)-8-methyl-2-(4-(4-methylpipe...) Show SMILES CN1CCN(CC1)C(=O)c1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 |(19.66,-4.1,;20.99,-3.33,;21,-1.79,;22.32,-1.02,;23.66,-1.79,;23.67,-3.33,;22.33,-4.1,;24.99,-1.02,;24.99,.52,;26.33,-1.79,;26.32,-3.33,;27.66,-4.1,;28.99,-3.33,;30.33,-4.1,;31.66,-3.33,;31.65,-1.79,;32.98,-1.02,;34.32,-1.78,;35.65,-1.02,;36.98,-1.78,;38.3,-1,;38.29,.53,;36.95,1.29,;39.62,1.31,;40.96,.54,;40.97,-1,;39.64,-1.77,;39.64,-3.31,;36.98,-3.32,;38.32,-4.09,;35.65,-4.09,;35.65,-5.63,;34.32,-3.33,;32.99,-4.1,;28.99,-1.78,;27.65,-1.02,)| Show InChI InChI=1S/C26H24Cl2N6O2/c1-32-10-12-34(13-11-32)24(35)16-6-8-18(9-7-16)30-26-29-15-17-14-19(25(36)33(2)23(17)31-26)22-20(27)4-3-5-21(22)28/h3-9,14-15H,10-13H2,1-2H3,(H,29,30,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Memorial Sloan-Kettering Cancer Center Curated by ChEMBL					Assay Description Inhibition of human recombinant P38alpha				Bioorg Med Chem Lett 19: 6872-6 (2009) Article DOI: 10.1016/j.bmcl.2009.10.085 BindingDB Entry DOI: 10.7270/Q2R49QV4
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