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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Aurora kinase A' and Ligand = 'BDBM50335340'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Aurora kinase A


(Homo sapiens (Human))		BDBM50335340
PNG
(4-(5-Methyl-1H-pyrazol-3-ylamino)-2-(4-nitrobenzyl...)
Show SMILES Cc1cc(Nc2nn(Cc3ccc(cc3)[N+]([O-])=O)c(=O)c3ccccc23)[nH]n1
Show InChI InChI=1S/C19H16N6O3/c1-12-10-17(22-21-12)20-18-15-4-2-3-5-16(15)19(26)24(23-18)11-13-6-8-14(9-7-13)25(27)28/h2-10H,11H2,1H3,(H2,20,21,22,23)
PDB
MMDB

NCI pathway
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Similars
Article
PubMed
n/an/a 109n/an/an/an/an/an/a



Evotec (UK) Ltd.

Curated by ChEMBL


Assay Description
Inhibition of Aurora A by ELISA

J Med Chem 54: 312-9 (2011)


Article DOI: 10.1021/jm101346r
BindingDB Entry DOI: 10.7270/Q29P32MB
More data for this
Ligand-Target Pair