BDBM50134615 CHEMBL3747324

SMILES: Cn1c2nc(Nc3ccc(cc3)N3CCCCC3)ncc2cc(Oc2c(Cl)cccc2Cl)c1=O

InChI Key: InChIKey=NVKGSBKKDOUQBL-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50134615   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50134615 (CHEMBL3747324) Show SMILES Cn1c2nc(Nc3ccc(cc3)N3CCCCC3)ncc2cc(Oc2c(Cl)cccc2Cl)c1=O Show InChI InChI=1S/C25H23Cl2N5O2/c1-31-23-16(14-21(24(31)33)34-22-19(26)6-5-7-20(22)27)15-28-25(30-23)29-17-8-10-18(11-9-17)32-12-3-2-4-13-32/h5-11,14-15H,2-4,12-13H2,1H3,(H,28,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>2.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Semmelweis University Curated by ChEMBL					Assay Description Inhibition of JNK1 (unknown origin)				Bioorg Med Chem Lett 26: 424-8 (2016) BindingDB Entry DOI: 10.7270/Q24T6M6J
					More data for this Ligand-Target Pair