Reaction Details Report a problem with these data
Target
Histone deacetylase 2
Ligand
BDBM375771
Substrate
n/a
Meas. Tech.
Enzyme Inhibition
IC50
3000±n/a nM
Citation
 Jacques, V; Rusche, JR; Peet, NP; Singh, J Histone deacetylase inhibitors US Patent  US9908899 Publication Date 3/6/2018 
Target
Name:
Histone deacetylase 2
Synonyms:
Cereblon/Histone deacetylase 2 | HD2 | HDAC2 | HDAC2_HUMAN | Histone deacetylase 2 (HDAC2) | Human HDAC2
Type:
Chromatin regulator; hydrolase; repressor
Mol. Mass.:
55356.54
Organism:
Homo sapiens (Human)
Description:
Q92769
Residue:
488
Sequence:
MAYSQGGGKKKVCYYYDGDIGNYYYGQGHPMKPHRIRMTHNLLLNYGLYRKMEIYRPHKATAEEMTKYHSDEYIKFLRSIRPDNMSEYSKQMQRFNVGEDCPVFDGLFEFCQLSTGGSVAGAVKLNRQQTDMAVNWAGGLHHAKKSEASGFCYVNDIVLAILELLKYHQRVLYIDIDIHHGDGVEEAFYTTDRVMTVSFHKYGEYFPGTGDLRDIGAGKGKYYAVNFPMRDGIDDESYGQIFKPIISKVMEMYQPSAVVLQCGADSLSGDRLGCFNLTVKGHAKCVEVVKTFNLPLLMLGGGGYTIRNVARCWTYETAVALDCEIPNELPYNDYFEYFGPDFKLHISPSNMTNQNTPEYMEKIKQRLFENLRMLPHAPGVQMQAIPEDAVHEDSGDEDGEDPDKRISIRASDKRIACDEEFSDSEDEGEGGRRNVADHKKGAKKARIEEDKKETEDKKTDVKEEDKSKDNSGEKTDTKGTKSEQLSNP
  
Inhibitor
Name:
BDBM375771
Synonyms:
US10301323, Compound F5 | US9908899, Compound F5
Type:
Small organic molecule
Emp. Form.:
C26H23ClN4O
Mol. Mass.:
442.94
SMILES:
Nc1ccccc1NC(=O)c1ccc(C=C2CN(Cc3ccc4cc[nH]c4c3)C2)c(Cl)c1 |(9.46,1.16,;9.46,-.38,;10.8,-1.15,;10.8,-2.69,;9.46,-3.46,;8.13,-2.69,;8.13,-1.15,;6.8,-.38,;5.46,-1.15,;5.46,-2.69,;4.13,-.38,;2.79,-1.15,;1.46,-.38,;1.46,1.16,;.13,1.93,;-1.21,1.16,;-2.69,1.55,;-3.09,.07,;-4.43,-.7,;-5.76,.07,;-5.76,1.61,;-7.09,2.38,;-8.43,1.61,;-9.89,2.08,;-10.8,.84,;-9.89,-.41,;-8.43,.07,;-7.09,-.7,;-1.6,-.33,;2.79,1.92,;2.79,3.46,;4.13,1.16,)|
Structure:
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