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Target
Aurora kinase A
Ligand
BDBM50333661
Substrate
n/a
Meas. Tech.
ChEMBL_700207 (CHEMBL1647308)
IC50
86150±n/a nM
Citation
 Morshed, MN; Cho, YS; Seo, SH; Han, KC; Yang, EG; Pae, AN Computational approach to the identification of novel Aurora-A inhibitors. Bioorg Med Chem 19:907-16 (2011) [PubMed]  Article 
Target
Name:
Aurora kinase A
Synonyms:
AIK | AIRK1 | ARK-1 | ARK1 | AURA | AURKA | AURKA_HUMAN | AYK1 | Aurora 2 | Aurora kinase A (AURA) | Aurora kinase A (AURKA) | Aurora kinase A (Aurora A) | Aurora kinase A (Aurora-2) | Aurora-related kinase 1 | Aurora/IPL1-related kinase 1 | BTAK | Breast tumor-amplified kinase | Breast-tumor-amplified kinase | IAK1 | STK15 | STK15 GN | STK6 | Serine/threonine kinase 15 | Serine/threonine-protein kinase 15 | Serine/threonine-protein kinase 6 | Serine/threonine-protein kinase aurora A | Serine/threonine-protein kinase aurora-A | Synonyms=AIK | aurora-2 | hARK1
Type:
Serine/threonine-protein kinase
Mol. Mass.:
45830.98
Organism:
Homo sapiens (Human)
Description:
O14965
Residue:
403
Sequence:
MDRSKENCISGPVKATAPVGGPKRVLVTQQFPCQNPLPVNSGQAQRVLCPSNSSQRIPLQAQKLVSSHKPVQNQKQKQLQATSVPHPVSRPLNNTQKSKQPLPSAPENNPEEELASKQKNEESKKRQWALEDFEIGRPLGKGKFGNVYLAREKQSKFILALKVLFKAQLEKAGVEHQLRREVEIQSHLRHPNILRLYGYFHDATRVYLILEYAPLGTVYRELQKLSKFDEQRTATYITELANALSYCHSKRVIHRDIKPENLLLGSAGELKIADFGWSVHAPSSRRTTLCGTLDYLPPEMIEGRMHDEKVDLWSLGVLCYEFLVGKPPFEANTYQETYKRISRVEFTFPDFVTEGARDLISRLLKHNPSQRPMLREVLEHPWITANSSKPSNCQNKESASKQS
  
Inhibitor
Name:
BDBM50333661
Synonyms:
CHEMBL1643142 | N-(2-cyclohexenylethyl)-2-(4-(6-methoxy-1H-indole-2-carbonyl)cyclohexyl)propanamide
Type:
Small organic molecule
Emp. Form.:
C27H36N2O3
Mol. Mass.:
436.5863
SMILES:
COc1ccc2cc([nH]c2c1)C(=O)C1CCC(CC1)C(C)C(=O)NCCC1=CCCCC1 |t:29,(-9.77,-30.03,;-9.8,-28.49,;-8.48,-27.7,;-7.13,-28.45,;-5.8,-27.66,;-5.83,-26.11,;-4.7,-25.05,;-5.36,-23.65,;-6.9,-23.84,;-7.19,-25.37,;-8.5,-26.16,;-4.62,-22.3,;-5.42,-20.98,;-3.08,-22.26,;-2.29,-23.58,;-.76,-23.55,;-.01,-22.2,;-.81,-20.88,;-2.35,-20.91,;1.53,-22.17,;2.27,-20.83,;2.32,-23.49,;1.58,-24.84,;3.86,-23.46,;4.66,-24.78,;6.2,-24.75,;6.99,-26.07,;8.53,-26.03,;9.32,-27.36,;8.57,-28.71,;7.03,-28.73,;6.24,-27.41,)|
Structure:
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