BDBM50192280 4-benzyl-3-bromo-N-5-6-methoxy-7-3-morpholinopropoxy)quinazolin-4-ylamino)pyrimidin-2-yl)benzamide::CHEMBL264903

SMILES: COc1cc2c(Nc3cnc(NC(=O)c4ccc(Cc5ccccc5)c(Br)c4)nc3)ncnc2cc1OCCCN1CCOCC1

InChI Key: InChIKey=GIBRVDUATQDCGO-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 = 50192280   

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))	BDBM50192280 (4-benzyl-3-bromo-N-5-6-methoxy-7-3-morpholinopropo...) Show SMILES COc1cc2c(Nc3cnc(NC(=O)c4ccc(Cc5ccccc5)c(Br)c4)nc3)ncnc2cc1OCCCN1CCOCC1 Show InChI InChI=1S/C34H34BrN7O4/c1-44-30-18-27-29(19-31(30)46-13-5-10-42-11-14-45-15-12-42)38-22-39-32(27)40-26-20-36-34(37-21-26)41-33(43)25-9-8-24(28(35)17-25)16-23-6-3-2-4-7-23/h2-4,6-9,17-22H,5,10-16H2,1H3,(H,38,39,40)(H,36,37,41,43)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Boston Curated by ChEMBL					Assay Description Inhibition of Aurora A				J Med Chem 49: 4805-8 (2006) Article DOI: 10.1021/jm060522a BindingDB Entry DOI: 10.7270/Q2QZ29KW
					More data for this Ligand-Target Pair