Reaction Details Report a problem with these data
Target
Aurora kinase B
Ligand
BDBM31093
Substrate
Histone H3 (aa 1-18)
Meas. Tech.
Enzyme Inhibition Assay
pH
7.5000±n/a
Temperature
295.1500±n/a K
IC50
9.3±n/a nM
Citation
 Aliagas-Martin, I; Burdick, D; Corson, L; Dotson, J; Drummond, J; Fields, C; Huang, OW; Hunsaker, T; Kleinheinz, T; Krueger, E; Liang, J; Moffat, J; Phillips, G; Pulk, R; Rawson, TE; Ultsch, M; Walker, L; Wiesmann, C; Zhang, B; Zhu, BY; Cochran, AG A class of 2,4-bisanilinopyrimidine Aurora A inhibitors with unusually high selectivity against Aurora B. J Med Chem 52:3300-7 (2009) [PubMed]  Article 
Target
Name:
Aurora kinase B
Synonyms:
Aurora kinase 2 | Aurora kinase B (AURKB) | AIM-1 | Aurora B kinase (aurB) | Aurora B-INCENP | Aurora-related kinase 2 | STK-1 | Serine/threonine-protein kinase aurora B | AURKB_HUMAN | AURKB | AIK2 | AIM1 | AIRK2 | ARK2 | STK1 | STK12 | STK5
Type:
Protein
Mol. Mass.:
39327.72
Organism:
Human
Description:
Q96GD4
Residue:
344
Sequence:
MAQKENSYPWPYGRQTAPSGLSTLPQRVLRKEPVTPSALVLMSRSNVQPTAAPGQKVMENSSGTPDILTRHFTIDDFEIGRPLGKGKFGNVYLAREKKSHFIVALKVLFKSQIEKEGVEHQLRREIEIQAHLHHPNILRLYNYFYDRRRIYLILEYAPRGELYKELQKSCTFDEQRTATIMEELADALMYCHGKKVIHRDIKPENLLLGLKGELKIADFGWSVHAPSLRRKTMCGTLDYLPPEMIEGRMHNEKVDLWCIGVLCYELLVGNPPFESASHNETYRRIVKVDLKFPASVPMGAQDLISKLLRHNPSERLPLAQVSAHPWVRANSRRVLPPSALQSVA
  
Inhibitor
Name:
BDBM31093
Synonyms:
cid_11712649 | 4-[[7-[2,6-bis(fluoranyl)phenyl]-9-chloranyl-5H-pyrimido[5,4-d][2]benzazepin-2-yl]amino]benzoic acid | BDBM31832 | 4-[[9-chloro-7-(2,6-difluorophenyl)-5H-pyrimido[5,4-d][2]benzazepin-2-yl]amino]benzoic acid | MLN-8054 | CHEMBL259084
Type:
Small organic molecule
Emp. Form.:
n/a
Mol. Mass.:
n/a
SMILES:
OC(=O)c1ccc(Nc2ncc3CN=C(c4cc(Cl)ccc4-c3n2)c2c(F)cccc2F)cc1 |c:13|
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
Histone H3 (aa 1-18)
Synonyms:
H31_HUMAN | H3C1 | H3FA | HIST1H3A | H3FL | HIST1H3B | H3FC HIST1H3C | H3FB | HIST1H3D | H3FD | HIST1H3E | H3FI | HIST1H3F | H3FH | HIST1H3G | H3FK | HIST1H3H | H3FF | HIST1H3I | H3FJ | HIST1H3J | GST fusion of N-terminus of Histone H3 (aa 1-18) | Histone H3
Type:
Peptide
Mol. Mass.:
1951.30
Organism:
Human
Description:
P68431 (aa 1-18)
Residue:
18
Sequence:
MARTKQTARKSTGGKAPR