Target
Bromodomain-containing protein 4 [342-460]
Ligand
BDBM362655
Substrate
n/a
Meas. Tech.
BRD4 AlphaScreen Assay
IC50
<25±n/a nM
Citation
 Combs, APSparks, RB Tricyclic heterocycles as bet protein inhibitors US Patent  US10227359 Publication Date 3/12/2019 
Target
Name:
Bromodomain-containing protein 4 [342-460]
Synonyms:
BRD4 | BRD4-BD2 (aa 342-460) | BRD4_HUMAN | Bromodomain containing 4 (aa 342-460) | Bromodomain-containing protein 4 (BRD4)(BD2) | HUNK1
Type:
Enzyme Catalytic Domain
Mol. Mass.:
13783.81
Organism:
Homo sapiens (Human)
Description:
a.a. 342-460 (BRD4-BD2)
Residue:
119
Sequence:
PAPEKSSKVSEQLKCCSGILKEMFAKKHAAYAWPFYKPVDVEALGLHDYCDIIKHPMDMSTIKSKLEAREYRDAQEFGADVRLMFSNCYKYNPPDHEVVAMARKLQDVFEMRFAKMPDE
  
Inhibitor
Name:
BDBM362655
Synonyms:
N-{1-[(4S)-7-(3,5-dimethylisoxazol-4-yl)- 4-pyridin-2-yl-4,5-dihydroimidazo[1,5,4- de][1,4]benzoxazin-2-yl]piperidin-4- yl}butanamide | US10227359, Example 10 | US9834565, Example 10
Type:
Small organic molecule
Emp. Form.:
C28H32N6O3
Mol. Mass.:
500.5921
SMILES:
CCCC(=O)NC1CCN(CC1)c1nc2ccc(-c3c(C)noc3C)c3OCC(c4ccccn4)n1c23 |(-6.26,8.21,;-5.49,6.88,;-3.95,6.88,;-3.18,5.55,;-3.95,4.21,;-1.64,5.55,;-.87,4.21,;-1.64,2.88,;-.87,1.54,;.67,1.54,;1.44,2.88,;.67,4.21,;1.44,.21,;2.98,.21,;3.55,-1.22,;4.88,-1.99,;4.88,-3.53,;3.55,-4.3,;3.55,-5.84,;2.3,-6.75,;.83,-6.27,;2.78,-8.21,;4.32,-8.21,;4.79,-6.75,;6.26,-6.27,;2.21,-3.53,;.88,-4.3,;-.46,-3.53,;-.46,-1.99,;-1.79,-1.22,;-3.12,-1.99,;-4.46,-1.22,;-4.46,.32,;-3.12,1.09,;-1.79,.32,;.88,-1.22,;2.21,-1.99,)|
Structure:
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