Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 1' and Ligand = 'BDBM50275620'   

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 1 (Homo sapiens (Human))	BDBM50275620 (3-benzyl-5-(4-hydroxy-3-methoxybenzylidene)-2-thio...) Show SMILES COc1cc(\C=C2/SC(=S)N(Cc3ccccc3)C2=O)ccc1O Show InChI InChI=1S/C18H15NO3S2/c1-22-15-9-13(7-8-14(15)20)10-16-17(21)19(18(23)24-16)11-12-5-3-2-4-6-12/h2-10,20H,11H2,1H3/b16-10-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.43E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sejong University Curated by ChEMBL					Assay Description Inhibition of recombinant ERK2 (unknown origin)				Bioorg Med Chem Lett 18: 5372-6 (2008) Article DOI: 10.1016/j.bmcl.2008.09.058 BindingDB Entry DOI: 10.7270/Q2J38SC3
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