Reaction Details Report a problem with these data
Target
Histone deacetylase
Ligand
BDBM50234114
Substrate
n/a
Meas. Tech.
ChEMBL_416719 (CHEMBL909985)
IC50
18±n/a nM
Citation
Mai, A; Massa, S; Rotili, D; Simeoni, S; Ragno, R; Botta, G; Nebbioso, A; Miceli, M; Altucci, L; Brosch, G Synthesis and biological properties of novel, uracil-containing histone deacetylase inhibitors. J Med Chem 49:6046-56 (2006) [PubMed] Article
More Info.:
Target
Name:
Histone deacetylase
Synonyms:
Histone deacetylase HD1B
Type:
PROTEIN
Mol. Mass.:
50930.01
Organism:
Zea mays
Description:
ChEMBL_422128
Residue:
458
Sequence:
MAASGEGVSLPSPAGGEDAHRRRVSYFYEPSIGDYYYGQGHPMKPHRIRMAHSLVVHYGLHRLLELSRPYPASEADIRRFHSDDYVAFLASATGNPGVLDPRAIKRFNVGEDCPVFDGLFPFCQASAGGSIGAAVKLNRGDADITVNWAGGLHHAKKSEASGFCYVNDIVLAILELLKFHRRVLYVDIDVHHGDGVEEAFFTTNRVMTVSFHKYGDFFPGTGHITDVGAAEGKHYALNVPLSDGIDDTTFRGLFQCIIKKVMEVYQPDVVVLQCGADSLAGDRLGCFNLSVKGHADCLRFLRSYNVPMMVLGGGGYTIRNVARCWCYETAVAVGVEPDNKLPYNDYYEYFGPDYTLHIQPKSVENLNTTKDLENIKNMILENLSKIEHVPSTQFHDRPSDPEAPEEKEEDMDKRPPQRSRLWSGGAYDSDTEDPDSLKSEGKDVTANFQMKDEPKDDL
Inhibitor
Name:
BDBM50234114
Synonyms:
6-(4-Benzyl-6-oxo-1,6-dihydro-pyrimidin-2-ylsulfanyl)-hexanoic acid hydroxyamide | 6-(4-benzyl-6-oxo-1,6-dihydropyrimidin-2-ylthio)-N-hydroxyhexanamide | CHEMBL218027 | N-hydroxy-6-(3,4-dihydro-4-oxo-6-benzyl-2-pyrimidinylthio)hexanamide
Type:
Small organic molecule
Emp. Form.:
C17H21N3O3S
Mol. Mass.:
347.432
SMILES:
ONC(=O)CCCCCSc1nc(Cc2ccccc2)cc(=O)[nH]1