BDBM25720 2-{[5-(morpholin-4-ylmethyl)pyridin-2-yl]amino}-1,3-thiazole-5-carbonitrile::aminothiazole analogue, 69

SMILES: N#Cc1cnc(Nc2ccc(CN3CCOCC3)cn2)s1

InChI Key: InChIKey=VLHLBQJLKNFDBH-UHFFFAOYSA-N

Data: 1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 25720   

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))	BDBM25720 (2-{[5-(morpholin-4-ylmethyl)pyridin-2-yl]amino}-1,...) Show SMILES N#Cc1cnc(Nc2ccc(CN3CCOCC3)cn2)s1 Show InChI InChI=1S/C14H15N5OS/c15-7-12-9-17-14(21-12)18-13-2-1-11(8-16-13)10-19-3-5-20-6-4-19/h1-2,8-9H,3-6,10H2,(H,16,17,18)	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	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis					Assay Description The biochemical activity of compounds was determined by incubation with Aurora A and substrates in the presence ATP/[gamma-33P] ATP. After incubatio...				ACS Chem Biol 3: 180-92 (2008) Article DOI: 10.1021/cb700200w BindingDB Entry DOI: 10.7270/Q2HX1B03
					More data for this Ligand-Target Pair