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Target
Cruzipain
Ligand
BDBM50114602
Substrate
n/a
Meas. Tech.
ChEMBL_48534 (CHEMBL660279)
IC50
80±n/a nM
Citation
 Du, X; Guo, C; Hansell, E; Doyle, PS; Caffrey, CR; Holler, TP; McKerrow, JH; Cohen, FE Synthesis and structure-activity relationship study of potent trypanocidal thio semicarbazone inhibitors of the trypanosomal cysteine protease cruzain. J Med Chem 45:2695-707 (2002) [PubMed]  Article 
Target
Name:
Cruzipain
Synonyms:
CYSP_TRYCR | Cruzain | Cruzaine | Major cysteine proteinase
Type:
Protein
Mol. Mass.:
49831.41
Organism:
Trypanosoma cruzi
Description:
P25779
Residue:
467
Sequence:
MSGWARALLLAAVLVVMACLVPAATASLHAEETLTSQFAEFKQKHGRVYESAAEEAFRLSVFRENLFLARLHAAANPHATFGVTPFSDLTREEFRSRYHNGAAHFAAAQERARVPVKVEVVGAPAAVDWRARGAVTAVKDQGQCGSCWAFSAIGNVECQWFLAGHPLTNLSEQMLVSCDKTDSGCSGGLMNNAFEWIVQENNGAVYTEDSYPYASGEGISPPCTTSGHTVGATITGHVELPQDEAQIAAWLAVNGPVAVAVDASSWMTYTGGVMTSCVSEQLDHGVLLVGYNDSAAVPYWIIKNSWTTQWGEEGYIRIAKGSNQCLVKEEASSAVVGGPGPTPEPTTTTTTSAPGPSPSYFVQMSCTDAACIVGCENVTLPTGQCLLTTSGVSAIVTCGAETLTEEVFLTSTHCSGPSVRSSVPLNKCNRLLRGSVEFFCGSSSSGRLADVDRQRRHQPYHSRHRRL
  
Inhibitor
Name:
BDBM50114602
Synonyms:
3-(3-Bromo-phenyl)-4-methyl-4,5-dihydro-pyrazole-1-carbothioic acid amide | CHEMBL406038
Type:
Small organic molecule
Emp. Form.:
C11H12BrN3S
Mol. Mass.:
298.202
SMILES:
CC1CN(N=C1c1cccc(Br)c1)C(N)=S |c:4|
Structure:
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