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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 = 'BDBM50394800'   
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))
BDBM50394800
PNG
(CHEMBL2163406)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@@H](O)C4)cc3)nn3cccc23)n[nH]1 |r|
Show InChI InChI=1S/C22H24N8O2S/c1-14-11-19(27-26-14)24-21-18-3-2-9-30(18)28-22(25-21)33-17-6-4-15(5-7-17)23-20(32)13-29-10-8-16(31)12-29/h2-7,9,11,16,31H,8,10,12-13H2,1H3,(H,23,32)(H2,24,25,26,27,28)/t16-/m1/s1
PDB
MMDB

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PC cid
PC sid
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Article
PubMed
n/an/an/a 11n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase A autophosphorylation in human HEK293 cells after 2 hrs by phosphor antibody readout assay


J Med Chem 55: 3250-60 (2012)


Article DOI: 10.1021/jm201702g
BindingDB Entry DOI: 10.7270/Q2W0971F
More data for this
Ligand-Target Pair