Target
Cruzipain
Ligand
BDBM50581378
Substrate
n/a
Meas. Tech.
ChEMBL_2150847 (CHEMBL5035309)
Ki
>5000±n/a nM
Citation
 Li, LChenna, BCYang, KSCole, TRGoodall, ZTGiardini, MMoghadamchargari, ZHernandez, EAGomez, JCalvet, CMBernatchez, JAMellott, DMZhu, JRademacher, AThomas, DBlankenship, LRDrelich, ALaganowsky, ATseng, CKLiu, WRWand, AJCruz-Reyes, JSiqueira-Neto, JLMeek, TD Self-Masked Aldehyde Inhibitors: A Novel Strategy for Inhibiting Cysteine Proteases. J Med Chem 64:11267-11287 (2021) [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:
BDBM50581378
Synonyms:
CHEMBL5077312
Type:
Small organic molecule
Emp. Form.:
C27H36N4O4
Mol. Mass.:
480.5991
SMILES:
CC(C)OC1Oc2ccccc2C[C@@H]1NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCN(C)CC1 |r|
Structure:
Search PDB for entries with ligand similarity: