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Target
Cruzipain
Ligand
BDBM50400188
Substrate
n/a
Meas. Tech.
ChEMBL_878617 (CHEMBL2189087)
IC50
8000±n/a nM
Citation
 Moreira, DR; Costa, SP; Hernandes, MZ; Rabello, MM; de Oliveira Filho, GB; de Melo, CM; da Rocha, LF; de Simone, CA; Ferreira, RS; Fradico, JR; Meira, CS; Guimarães, ET; Srivastava, RM; Pereira, VR; Soares, MB; Leite, AC Structural investigation of anti-Trypanosoma cruzi 2-iminothiazolidin-4-ones allows the identification of agents with efficacy in infected mice. J Med Chem 55:10918-36 (2012) [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:
BDBM50400188
Synonyms:
CHEMBL2180670
Type:
Small organic molecule
Emp. Form.:
C16H21N3O2S
Mol. Mass.:
319.422
SMILES:
CC(C)c1sc(=NN=C(C)COc2ccccc2)n(C)c1O |w:7.6|
Structure:
Search PDB for entries with ligand similarity: