BDBM50192282 2-N,N-dipropylsulfamoyl)-N-5-6-methoxy-7-3-morpholinopropoxy)quinazolin-4-ylamino)pyrimidin-2-yl)pyrimidine-5-carboxamide::CHEMBL214755

SMILES: CCCN(CCC)S(=O)(=O)c1ncc(cn1)C(=O)Nc1ncc(Nc2ncnc3cc(OCCCN4CCOCC4)c(OC)cc23)cn1

InChI Key: InChIKey=BXDOBQYUCLJNAE-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 = 50192282   

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))	BDBM50192282 (2-N,N-dipropylsulfamoyl)-N-5-6-methoxy-7-3-morphol...) Show SMILES CCCN(CCC)S(=O)(=O)c1ncc(cn1)C(=O)Nc1ncc(Nc2ncnc3cc(OCCCN4CCOCC4)c(OC)cc23)cn1 Show InChI InChI=1S/C31H40N10O6S/c1-4-7-41(8-5-2)48(43,44)31-34-17-22(18-35-31)29(42)39-30-32-19-23(20-33-30)38-28-24-15-26(45-3)27(16-25(24)36-21-37-28)47-12-6-9-40-10-13-46-14-11-40/h15-21H,4-14H2,1-3H3,(H,36,37,38)(H,32,33,39,42)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.90E+3	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