BDBM12411 4-(dipropylsulfamoyl)-N-[5-({6-methoxy-7-[3-(morpholin-4-yl)propoxy]quinazolin-4-yl}amino)pyrimidin-2-yl]benzamide::quinazoline deriv. 9

SMILES: CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)Nc1ncc(Nc2ncnc3cc(OCCCN4CCOCC4)c(OC)cc23)cn1

InChI Key: InChIKey=WDUVZCKAMIREJE-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 = 12411   

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))	BDBM12411 (4-(dipropylsulfamoyl)-N-[5-({6-methoxy-7-[3-(morph...) Show SMILES CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)Nc1ncc(Nc2ncnc3cc(OCCCN4CCOCC4)c(OC)cc23)cn1 Show InChI InChI=1S/C33H42N8O6S/c1-4-11-41(12-5-2)48(43,44)26-9-7-24(8-10-26)32(42)39-33-34-21-25(22-35-33)38-31-27-19-29(45-3)30(20-28(27)36-23-37-31)47-16-6-13-40-14-17-46-18-15-40/h7-10,19-23H,4-6,11-18H2,1-3H3,(H,36,37,38)(H,34,35,39,42)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.90E+3	n/a	n/a	n/a	n/a	7.5	22
AstraZeneca					Assay Description In vitro kinase assay using recombinant Aurora A purified from Sf9 cells, was incubated at room temperature with substrate, and test compounds in the...				Bioorg Med Chem Lett 16: 1320-23 (2006) Article DOI: 10.1016/j.bmcl.2005.11.053 BindingDB Entry DOI: 10.7270/Q2WH2N7M
					More data for this Ligand-Target Pair