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Target
Histone deacetylase 1
Ligand
BDBM50561899
Substrate
n/a
Meas. Tech.
ChEMBL_2076164 (CHEMBL4731698)
IC50
6500±n/a nM
Citation
 Saraswati, AP; Relitti, N; Brindisi, M; Osko, JD; Chemi, G; Federico, S; Grillo, A; Brogi, S; McCabe, NH; Turkington, RC; Ibrahim, O; O'Sullivan, J; Lamponi, S; Ghanim, M; Kelly, VP; Zisterer, D; Amet, R; Hannon Barroeta, P; Vanni, F; Ulivieri, C; Herp, D; Sarno, F; Di Costanzo, A; Saccoccia, F; Ruberti, G; Jung, M; Altucci, L; Gemma, S; Butini, S; Christianson, DW; Campiani, G Spiroindoline-Capped Selective HDAC6 Inhibitors: Design, Synthesis, Structural Analysis, and Biological Evaluation. ACS Med Chem Lett 11:2268-2276 (2020) [PubMed]  Article 
Target
Name:
Histone deacetylase 1
Synonyms:
Cereblon/Histone deacetylase 1 | HD1 | HDAC1 | HDAC1_HUMAN | Histone deacetylase 1 (HDAC1) | Human HDAC1 | RPD3L1
Type:
Enzyme
Mol. Mass.:
55090.27
Organism:
Human
Description:
Q13547
Residue:
482
Sequence:
MAQTQGTRRKVCYYYDGDVGNYYYGQGHPMKPHRIRMTHNLLLNYGLYRKMEIYRPHKANAEEMTKYHSDDYIKFLRSIRPDNMSEYSKQMQRFNVGEDCPVFDGLFEFCQLSTGGSVASAVKLNKQQTDIAVNWAGGLHHAKKSEASGFCYVNDIVLAILELLKYHQRVLYIDIDIHHGDGVEEAFYTTDRVMTVSFHKYGEYFPGTGDLRDIGAGKGKYYAVNYPLRDGIDDESYEAIFKPVMSKVMEMFQPSAVVLQCGSDSLSGDRLGCFNLTIKGHAKCVEFVKSFNLPMLMLGGGGYTIRNVARCWTYETAVALDTEIPNELPYNDYFEYFGPDFKLHISPSNMTNQNTNEYLEKIKQRLFENLRMLPHAPGVQMQAIPEDAIPEESGDEDEDDPDKRISICSSDKRIACEEEFSDSEEEGEGGRKNSSNFKKAKRVKTEDEKEKDPEEKKEVTEEEKTKEEKPEAKGVKEEVKLA
  
Inhibitor
Name:
BDBM50561899
Synonyms:
CHEMBL4787293
Type:
Small organic molecule
Emp. Form.:
C27H29N3O2
Mol. Mass.:
427.5381
SMILES:
ONC(=O)c1ccc(CN2CCC3(CN(Cc4ccccc4)c4ccccc34)CC2)cc1
Structure:
Search PDB for entries with ligand similarity: