Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 383.8 BDBM50358531

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
Mitogen-activated protein kinase 8 (Homo sapiens (Human))	BDBM50358531 (CHEMBL1923214) Show SMILES COc1ccc(Oc2cc(N(C)c3ccccc3C(N)=O)c(Cl)cn2)cc1 Show InChI InChI=1S/C20H18ClN3O3/c1-24(17-6-4-3-5-15(17)20(22)25)18-11-19(23-12-16(18)21)27-14-9-7-13(26-2)8-10-14/h3-12H,1-2H3,(H2,22,25)	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	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of JNK1 using biotinylated-ATF2 as substrate by HTRF assay				Bioorg Med Chem Lett 21: 7072-5 (2011) Article DOI: 10.1016/j.bmcl.2011.09.090 BindingDB Entry DOI: 10.7270/Q2V69K0W
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