Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 400.8 BDBM100616

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))	BDBM100616 (US8501732, I-176) Show SMILES Clc1ccc2c(c1)n(cc(CNc1nc3ccccc3[nH]1)c2=O)-c1ccccc1 Show InChI InChI=1S/C23H17ClN4O/c24-16-10-11-18-21(12-16)28(17-6-2-1-3-7-17)14-15(22(18)29)13-25-23-26-19-8-4-5-9-20(19)27-23/h1-12,14H,13H2,(H2,25,26,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	850	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