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PubMed code 23707920

Compile data set for download or QSAR
Found 3 hits of Enzyme Inhibition Constant Data   
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))
BDBM52755
PNG
(MLS001004059 | N-[2-(2-cyano-4-nitro-anilino)ethyl...)
Show SMILES CC(=O)NCCNc1ccc(cc1C#N)[N+]([O-])=O
Show InChI InChI=1S/C11H12N4O3/c1-8(16)13-4-5-14-11-3-2-10(15(17)18)6-9(11)7-12/h2-3,6,14H,4-5H2,1H3,(H,13,16)
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.60n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of Aurora A kinase (unknown origin) by Z'-LYTE kinase assay


Eur J Med Chem 65: 151-7 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.058
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM52755
PNG
(MLS001004059 | N-[2-(2-cyano-4-nitro-anilino)ethyl...)
Show SMILES CC(=O)NCCNc1ccc(cc1C#N)[N+]([O-])=O
Show InChI InChI=1S/C11H12N4O3/c1-8(16)13-4-5-14-11-3-2-10(15(17)18)6-9(11)7-12/h2-3,6,14H,4-5H2,1H3,(H,13,16)
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.70n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of Aurora B kinase (unknown origin) by Z'-LYTE kinase assay


Eur J Med Chem 65: 151-7 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.058
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM52755
PNG
(MLS001004059 | N-[2-(2-cyano-4-nitro-anilino)ethyl...)
Show SMILES CC(=O)NCCNc1ccc(cc1C#N)[N+]([O-])=O
Show InChI InChI=1S/C11H12N4O3/c1-8(16)13-4-5-14-11-3-2-10(15(17)18)6-9(11)7-12/h2-3,6,14H,4-5H2,1H3,(H,13,16)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 141n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of recombinant Aurora B kinase (unknown origin) expressed in Escherichia coli


Eur J Med Chem 65: 151-7 (2013)


Article DOI: 10.1016/j.ejmech.2013.04.058
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%