Reaction Details Report a problem with these data
Target
Cruzipain
Ligand
BDBM50330927
Substrate
n/a
Meas. Tech.
ChEMBL_683902 (CHEMBL1285900)
IC50
20400±n/a nM
Citation
 Hernandes, MZ; Rabello, MM; Leite, AC; Cardoso, MV; Moreira, DR; Brondani, DJ; Simone, CA; Reis, LC; Souza, MA; Pereira, VR; Ferreira, RS; McKerrow, JH Studies toward the structural optimization of novel thiazolylhydrazone-based potent antitrypanosomal agents. Bioorg Med Chem 18:7826-35 (2010) [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:
BDBM50330927
Synonyms:
2-[(p-Methylphenylthio)ethylidenehydrazinyl]-5-methylthiazolidin-4-one | CHEMBL1276301
Type:
Small organic molecule
Emp. Form.:
C13H15N3OS2
Mol. Mass.:
293.408
SMILES:
Cc1sc(N=NCCSc2ccc(C)cc2)nc1O |w:4.3|
Structure:
Search PDB for entries with ligand similarity: