Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 339.8 BDBM50345836

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

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
MAP kinase-activated protein kinase 2 (Homo sapiens (Human))	BDBM50345836 (1-((3-amino-6-chloro-5-(methylthio)pyrazin-2-yl)me...) Show SMILES CSc1nc(N)c(CNC(=S)Nc2ccccc2)nc1Cl Show InChI InChI=1S/C13H14ClN5S2/c1-21-12-10(14)18-9(11(15)19-12)7-16-13(20)17-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H2,15,19)(H2,16,17,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of MK2 using biotin-LCAYSRALSRQLSSGVSEIRH substrate				Bioorg Med Chem Lett 19: 3238-42 (2009) Article DOI: 10.1016/j.bmcl.2009.04.088 BindingDB Entry DOI: 10.7270/Q2QZ2B88
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