Reaction Details  Report a problem with these data
Target
Histone deacetylase 2
Ligand
BDBM50569267
Substrate
n/a
Meas. Tech.
ChEMBL_2108614 (CHEMBL4817289)
IC50
2650±n/a nM
Citation
 Zhang, XJ; Liu, MH; Luo, YS; Han, GY; Ma, ZQ; Huang, F; Wang, Y; Miao, ZY; Zhang, WN; Sheng, CQ; Yao, JZ Novel dual-mode antitumor chlorin-based derivatives as potent photosensitizers and histone deacetylase inhibitors for photodynamic therapy and chemotherapy. Eur J Med Chem 217:0 (2021) [PubMed]  Article
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:
BDBM50569267
Synonyms:
CHEMBL4852895
Type:
Small organic molecule
Emp. Form.:
C48H49N7O6
Mol. Mass.:
819.946
SMILES:
CCc1c(C)c2cc3[nH]c(cc4nc([C@@H](CCC(=O)Nc5ccc(cc5)C(=O)Nc5ccccc5N)[C@@H]4C)c(C(=O)OC)c4[nH]c(cc1n2)c(C)c4C(=O)OC)c(C)c3C=C |r|
Structure:
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