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TargetHistone deacetylase
LigandBDBM50135767
Substrate/Competitorn/a
Meas. Tech.ChEMBL_87394 (CHEMBL691509)
IC50 0.8±n/a nM
Citation Miller, TAWitter, DJBelvedere, S Histone deacetylase inhibitors. J Med Chem46:5097-116 (2003) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Histone deacetylase
Name:Histone deacetylase
Synonyms:n/a
Type:PROTEIN
Mol. Mass.:50433.01
Organism:Cryptosporidium parvum
Description:ChEMBL_79057
Residue:444
Sequence:
MAKRVSYFYDGDIGSYYYGPGHPMKPQRIRMAHNLILSYDLYKHMEIYKPHKSPQSELVY
FHEEDYINFLSSINPDNSKDFGLQLKRFNLGETTDCPVFDGLFEFQQICAGGSIDGAYKL
NNEQSDICINWSGGLHHAKRSEASGFCYINDIVLGILELLKYHARVMYIDIDVHHGDGVE
EAFYLSHRVLTVSFHKFGEFFPGTGDITDIGVAQGKYYSVNVPLNDGIDDDSFLSLFKPI
ISKCIEVYRPGAIVLQCGADSVRGDRLGRFNLSIKGHAECVEFCKKFNIPLLILGGGGYT
IRNVARTWAYETATILDRTDLISDNIPLNDYYDYFAPDFKLHIPPLNLPNMNSPEHLEKI
KAKVIDNLRYLEHAPGVEFAYVPSDFFDREASNLQKQEDEEREEELSSWQGGGRAAGSTE
SQGNHNEKPKSSRKLQKEHASEFY
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50135767
n/a
NameBDBM50135767
Synonyms:6-[(6S,9S,12S,14aR)-6-sec-Butyl-9-(1-methoxy-1H-indol-3-ylmethyl)-5,8,11,14-tetraoxo-tetradecahydro-4a,7,10,13-tetraaza-benzocyclododecen-12-yl]-hexanoic acid methyl ester | CHEMBL356177
TypeSmall organic molecule
Emp. Form.C33H47N5O7
Mol. Mass.625.7556
SMILESCCC(C)[C@@H]1NC(=O)[C@H](Cc2cn(OC)c3ccccc23)NC(=O)[C@H](CCCCCC(=O)OC)NC(=O)[C@H]2CCCCN2C1=O
Structure
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