BDBM50318576 CHEMBL1086444::[4-(6-Bromo-7-piperazin-1-yl-3H-imidazo[4,5-b]pyridin-2-yl)-phenyl]-dimethylamine

SMILES: CN(C)c1ccc(cc1)-c1nc2ncc(Br)c(N3CCNCC3)c2[nH]1

InChI Key: InChIKey=JHIAAOWEBWPFOE-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 = 50318576   

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
Aurora kinase A (Homo sapiens (Human))	BDBM50318576 (CHEMBL1086444 | [4-(6-Bromo-7-piperazin-1-yl-3H-im...) Show SMILES CN(C)c1ccc(cc1)-c1nc2ncc(Br)c(N3CCNCC3)c2[nH]1 Show InChI InChI=1S/C18H21BrN6/c1-24(2)13-5-3-12(4-6-13)17-22-15-16(25-9-7-20-8-10-25)14(19)11-21-18(15)23-17/h3-6,11,20H,7-10H2,1-2H3,(H,21,22,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	365	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Cancer Research Curated by ChEMBL					Assay Description Inhibition of human recombinant Aurora A expressed in baculovirus system				J Med Chem 53: 5213-28 (2010) Article DOI: 10.1021/jm100262j BindingDB Entry DOI: 10.7270/Q2GB251P
					More data for this Ligand-Target Pair				3D Structure (docked)