Target
Phosphotransferase
Ligand
BDBM61961
Substrate
n/a
Meas. Tech.
Confirmation assay for inhibitors of Trypanosoma brucei hexokinase 1-Analogue-first series
IC50
25000±n/a nM
Citation
 PubChem, PC Confirmation assay for inhibitors of Trypanosoma brucei hexokinase 1-Analogue-first series PubChem Bioassay (2010)[AID] 
Target
Name:
Phosphotransferase
Synonyms:
hexokinase
Type:
Enzyme Catalytic Domain
Mol. Mass.:
51160.00
Organism:
Trypanosoma brucei
Description:
gi_70832125
Residue:
471
Sequence:
MSRRLNNILEHISIQGNDGETVRAVKRDVAMAALTNQFTMSVESMRQIMTYLLYEMVEGLEGRESTVRMLPSYVYKADPKRATGVFYALDLGGTNFRVLRVACKEGAVVDSSTSAFKIPKYALEGNATDLFDFIASNVKKTMETRAPEDLNRTVPLGFTFSFPVEQTKVNRGVLIRWTKGFSTKGVQGNDVIALLQAAFGRVSLKVNVVALCNDTVATMISHYFKDPEVQVGVIIGTGSNACYFETASAVTKDPAVAARGSALTPISMESGNFDSKYRFVLPTTKFDLDIDDASLNKGQQALEKMISGMYLGEIARRVIVHLSSINCLPAALQTALGNRGSFESRFAGMISADRMPGLQFTRSTIQKVCGVDVQSIEDLRIIRDVCRLVRGRAAQLSASFCCAPLVKTQTQGRATIAIDGSVFEKIPSFRRVLQDNINRILGPECDVRAVLAKGGSGVGAALISAIVADGK
  
Inhibitor
Name:
BDBM61961
Synonyms:
2-(3-keto-1,2-benzothiazol-2-yl)-N-[2-(trifluoromethyl)phenyl]acetamide | 2-(3-keto-1,2-benzothiazol-2-yl)-N-[2-(trifluoromethyl)phenyl]acetamide (12) | 2-(3-oxidanylidene-1,2-benzothiazol-2-yl)-N-[2-(trifluoromethyl)phenyl]ethanamide | 2-(3-oxo-1,2-benzothiazol-2-yl)-N-[2-(trifluoromethyl)phenyl]acetamide | KSC-09-143 | KUC105610N | cid_45479195
Type:
Small organic molecule
Emp. Form.:
C16H11F3N2O2S
Mol. Mass.:
352.331
SMILES:
FC(F)(F)c1ccccc1NC(=O)Cn1sc2ccccc2c1=O
Structure:
Search PDB for entries with ligand similarity: