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Target
Bromodomain-containing protein 4 [42-168]
Ligand
BDBM362428
Substrate
n/a
Meas. Tech.
AlphaScreen Assay
IC50
<25±n/a nM
Citation
 Combs, AP; Sparks, RB Tricyclic heterocycles as bet protein inhibitors US Patent  US9834565 Publication Date 12/5/2017 
Target
Name:
Bromodomain-containing protein 4 [42-168]
Synonyms:
BRD4 | BRD4 BD1 (aa 42-168) | BRD4_HUMAN | Bromodomain-containing protein 4 Bromo Domain 1 | HUNK1
Type:
Enzyme Catalytic Domain
Mol. Mass.:
15054.68
Organism:
Homo sapiens (Human)
Description:
O60885[42-168]
Residue:
127
Sequence:
STNPPPPETSNPNKPKRQTNQLQYLLRVVLKTLWKHQFAWPFQQPVDAVKLNLPDYYKIIKTPMDMGTIKKRLENNYYWNAQECIQDFNTMFTNCYIYNKPGDDIVLMAEALEKLFLQKINELPTEE
  
Inhibitor
Name:
BDBM362428
Synonyms:
(4S)-7-(3,5-Dimethylisoxazol-4-yl)-2-(4-isobutyrylpiperazin-1-yl)-4-pyridin-2-yl-4,5-dihydroimidazo[1,5,4-de][1,4]benzoxazine | US10227359, Example 1 | US10618910, Example 1 | US9834565, Example 1
Type:
Small organic molecule
Emp. Form.:
C27H30N6O3
Mol. Mass.:
486.5655
SMILES:
CC(C)C(=O)N1CCN(CC1)c1nc2ccc(-c3c(C)noc3C)c3OC[C@H](c4ccccn4)n1c23 |r,wD:27.29,(6.14,4.2,;5.37,5.53,;6.14,6.86,;3.83,5.53,;3.06,6.86,;3.06,4.2,;3.83,2.86,;3.06,1.53,;1.52,1.53,;.75,2.86,;1.52,4.2,;.75,.19,;1.38,-1.21,;.23,-2.24,;.23,-3.78,;-1.1,-4.55,;-2.44,-3.78,;-3.77,-4.55,;-3.77,-6.09,;-2.44,-6.86,;-5.23,-6.57,;-6.14,-5.32,;-5.23,-4.08,;-6,-2.74,;-2.44,-2.24,;-3.77,-1.47,;-3.77,.07,;-2.44,.84,;-2.44,2.38,;-3.77,3.15,;-3.77,4.69,;-2.44,5.46,;-1.1,4.69,;-1.1,3.15,;-1.1,.07,;-1.1,-1.47,)|
Structure:
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