Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 3' and Ligand = 'BDBM50232018'   

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 3 (Homo sapiens (Human))	BDBM50232018 (CHEMBL4088654) Show SMILES CNc1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)c(C)c2)ncn1 Show InChI InChI=1S/C20H17ClF3N5O2/c1-11-7-13(31-18-9-17(25-2)26-10-27-18)4-6-16(11)29-19(30)28-12-3-5-15(21)14(8-12)20(22,23)24/h3-10H,1-2H3,(H,25,26,27)(H2,28,29,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University Curated by ChEMBL					Assay Description Inhibition of full length recombinant human N-terminal GST-tagged ERK1 expressed in Escherichia coli in presence of [gamma33P]ATP by HTRF assay				Eur J Med Chem 127: 997-1011 (2017) Article DOI: 10.1016/j.ejmech.2016.11.009 BindingDB Entry DOI: 10.7270/Q2JH3PDJ
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