Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 528.9 BDBM100565

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))	BDBM100565 (US8501732, I-125) Show SMILES COC(=O)c1c(CNC(=O)c2ccc(cc2)-c2noc(C)n2)c(=O)c2ccc(Cl)cc2n1-c1ccccc1 Show InChI InChI=1S/C28H21ClN4O5/c1-16-31-26(32-38-16)17-8-10-18(11-9-17)27(35)30-15-22-24(28(36)37-2)33(20-6-4-3-5-7-20)23-14-19(29)12-13-21(23)25(22)34/h3-14H,15H2,1-2H3,(H,30,35)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description In vitro JNK1 assay.				US Patent US8501732 (2013) BindingDB Entry DOI: 10.7270/Q2RF5SP9
					More data for this Ligand-Target Pair