BDBM50194982 4-(3-chloro-4-fluorophenylamino)-6-((2-ethyl-1H-imidazol-4-yl)methylamino)quinoline-3-carbonitrile::CHEMBL374241

SMILES: CCc1ncc(CNc2ccc3ncc(C#N)c(Nc4ccc(F)c(Cl)c4)c3c2)[nH]1

InChI Key: InChIKey=NPLPHZCUFCKWRE-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 = 50194982   

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 kinase kinase 8 (Homo sapiens (Human))	BDBM50194982 (4-(3-chloro-4-fluorophenylamino)-6-((2-ethyl-1H-im...) Show SMILES CCc1ncc(CNc2ccc3ncc(C#N)c(Nc4ccc(F)c(Cl)c4)c3c2)[nH]1 Show InChI InChI=1S/C22H18ClFN6/c1-2-21-28-12-16(29-21)11-26-14-4-6-20-17(7-14)22(13(9-25)10-27-20)30-15-3-5-19(24)18(23)8-15/h3-8,10,12,26H,2,11H2,1H3,(H,27,30)(H,28,29)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	640	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of Tpl2 kinase by ELISA				Bioorg Med Chem Lett 16: 6067-72 (2006) Article DOI: 10.1016/j.bmcl.2006.08.102 BindingDB Entry DOI: 10.7270/Q2W958TR
					More data for this Ligand-Target Pair