Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetNAD-dependent histone deacetylase SIR2
LigandBDBM50177983
Substrate/Competitorn/a
Meas. Tech.ChEMBL_326721 (CHEMBL859799)
IC50 62000±n/a nM
Citation Mai, AMassa, SLavu, SPezzi, RSimeoni, SRagno, RMariotti, FRChiani, FCamilloni, GSinclair, DA Design, synthesis, and biological evaluation of sirtinol analogues as class III histone/protein deacetylase (Sirtuin) inhibitors. J Med Chem48:7789-95 (2005) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
NAD-dependent histone deacetylase SIR2
Name:NAD-dependent histone deacetylase SIR2
Synonyms:MAR1 | SIR2 | SIR2_YEAST
Type:PROTEIN
Mol. Mass.:63277.80
Organism:Saccharomyces cerevisiae
Description:ChEMBL_942450
Residue:562
Sequence:
MTIPHMKYAVSKTSENKVSNTVSPTQDKDAIRKQPDDIINNDEPSHKKIKVAQPDSLRET
NTTDPLGHTKAALGEVASMELKPTNDMDPLAVSAASVVSMSNDVLKPETPKGPIIISKNP
SNGIFYGPSFTKRESLNARMFLKYYGAHKFLDTYLPEDLNSLYIYYLIKLLGFEVKDQAL
IGTINSIVHINSQERVQDLGSAISVTNVEDPLAKKQTVRLIKDLQRAINKVLCTRLRLSN
FFTIDHFIQKLHTARKILVLTGAGVSTSLGIPDFRSSEGFYSKIKHLGLDDPQDVFNYNI
FMHDPSVFYNIANMVLPPEKIYSPLHSFIKMLQMKGKLLRNYTQNIDNLESYAGISTDKL
VQCHGSFATATCVTCHWNLPGERIFNKIRNLELPLCPYCYKKRREYFPEGYNNKVGVAAS
QGSMSERPPYILNSYGVLKPDITFFGEALPNKFHKSIREDILECDLLICIGTSLKVAPVS
EIVNMVPSHVPQVLINRDPVKHAEFDLSLLGYCDDIAAMVAQKCGWTIPHKKWNDLKNKN
FKCQEKDKGVYVVTSDEHPKTL
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50177983
n/a
NameBDBM50177983
Synonyms:(R)-sirtinol | CHEMBL198582
TypeSmall organic molecule
Emp. Form.C26H22N2O2
Mol. Mass.394.4651
SMILESC[C@@H](NC(=O)c1ccccc1\N=C\c1c(O)ccc2ccccc12)c1ccccc1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: