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Target
Bromodomain-containing protein 4
Ligand
BDBM50549040
Substrate
n/a
Meas. Tech.
ChEMBL_2023676 (CHEMBL4677489)
IC50
254±n/a nM
Citation
 Yang, Y; Chen, P; Zhao, L; Zhang, B; Xu, C; Zhang, H; Zhou, J Design, synthesis and biological evaluation of imidazolopyridone derivatives as novel BRD4 inhibitors. Bioorg Med Chem 29:0 (2021) [PubMed]  Article 
Target
Name:
Bromodomain-containing protein 4
Synonyms:
BRD4 | BRD4_HUMAN | Bromodomain-containing protein 4 (BRD4) | HUNK1 | Protein HUNK1
Type:
Protein
Mol. Mass.:
152264.84
Organism:
Homo sapiens (Human)
Description:
O60885
Residue:
1362
Sequence:
MSAESGPGTRLRNLPVMGDGLETSQMSTTQAQAQPQPANAASTNPPPPETSNPNKPKRQTNQLQYLLRVVLKTLWKHQFAWPFQQPVDAVKLNLPDYYKIIKTPMDMGTIKKRLENNYYWNAQECIQDFNTMFTNCYIYNKPGDDIVLMAEALEKLFLQKINELPTEETEIMIVQAKGRGRGRKETGTAKPGVSTVPNTTQASTPPQTQTPQPNPPPVQATPHPFPAVTPDLIVQTPVMTVVPPQPLQTPPPVPPQPQPPPAPAPQPVQSHPPIIAATPQPVKTKKGVKRKADTTTPTTIDPIHEPPSLPPEPKTTKLGQRRESSRPVKPPKKDVPDSQQHPAPEKSSKVSEQLKCCSGILKEMFAKKHAAYAWPFYKPVDVEALGLHDYCDIIKHPMDMSTIKSKLEAREYRDAQEFGADVRLMFSNCYKYNPPDHEVVAMARKLQDVFEMRFAKMPDEPEEPVVAVSSPAVPPPTKVVAPPSSSDSSSDSSSDSDSSTDDSEEERAQRLAELQEQLKAVHEQLAALSQPQQNKPKKKEKDKKEKKKEKHKRKEEVEENKKSKAKEPPPKKTKKNNSSNSNVSKKEPAPMKSKPPPTYESEEEDKCKPMSYEEKRQLSLDINKLPGEKLGRVVHIIQSREPSLKNSNPDEIEIDFETLKPSTLRELERYVTSCLRKKRKPQAEKVDVIAGSSKMKGFSSSESESSSESSSSDSEDSETEMAPKSKKKGHPGREQKKHHHHHHQQMQQAPAPVPQQPPPPPQQPPPPPPPQQQQQPPPPPPPPSMPQQAAPAMKSSPPPFIATQVPVLEPQLPGSVFDPIGHFTQPILHLPQPELPPHLPQPPEHSTPPHLNQHAVVSPPALHNALPQQPSRPSNRAAALPPKPARPPAVSPALTQTPLLPQPPMAQPPQVLLEDEEPPAPPLTSMQMQLYLQQLQKVQPPTPLLPSVKVQSQPPPPLPPPPHPSVQQQLQQQPPPPPPPQPQPPPQQQHQPPPRPVHLQPMQFSTHIQQPPPPQGQQPPHPPPGQQPPPPQPAKPQQVIQHHHSPRHHKSDPYSTGHLREAPSPLMIHSPQMSQFQSLTHQSPPQQNVQPKKQELRAASVVQPQPLVVVKEEKIHSPIIRSEPFSPSLRPEPPKHPESIKAPVHLPQRPEMKPVDVGRPVIRPPEQNAPPPGAPDKDKQKQEPKTPVAPKKDLKIKNMGSWASLVQKHPTTPSSTAKSSSDSFEQFRRAAREKEEREKALKAQAEHAEKEKERLRQERMRSREDEDALEQARRAHEEARRRQEQQQQQRQEQQQQQQQQAAAVAAAATPQAQSSQPQSMLDQQRELARKREQERRRREAMAATIDMNFQSDLLSIFEENLF
  
Inhibitor
Name:
BDBM50549040
Synonyms:
CHEMBL4784210
Type:
Small organic molecule
Emp. Form.:
C27H26N4O5S
Mol. Mass.:
518.584
SMILES:
CCS(=O)(=O)c1ccc(Oc2ccc(C)c(c2)-c2c(C)noc2C)c(c1)-c1cn(C)c(=O)c2cncn12 |(10.12,-18.86,;11.36,-17.96,;12.77,-18.58,;13.53,-19.91,;12,-19.91,;14.11,-17.81,;15.45,-18.58,;16.78,-17.81,;16.78,-16.27,;18.12,-15.5,;19.44,-16.27,;19.44,-17.81,;20.78,-18.58,;22.12,-17.81,;23.45,-18.58,;22.12,-16.27,;20.78,-15.5,;23.45,-15.5,;24.85,-16.12,;25.18,-17.62,;25.89,-14.98,;25.12,-13.64,;23.61,-13.96,;22.46,-12.93,;15.45,-15.5,;14.11,-16.27,;15.45,-13.96,;14.11,-13.18,;14.11,-11.64,;12.78,-10.87,;15.45,-10.87,;15.45,-9.33,;16.78,-11.64,;18.24,-11.17,;19.15,-12.41,;18.24,-13.66,;16.78,-13.18,)|
Structure:
Search PDB for entries with ligand similarity: