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Target
Cruzipain
Ligand
BDBM50246507
Substrate
n/a
Meas. Tech.
ChEMBL_559677 (CHEMBL1010075)
IC50
100000±n/a nM
Citation
 Zanatta, N; Amaral, SS; Dos Santos, JM; de Mello, DL; Fernandes, Lda S; Bonacorso, HG; Martins, MA; Andricopulo, AD; Borchhardt, DM Convergent synthesis and cruzain inhibitory activity of novel 2-(N'-benzylidenehydrazino)-4-trifluoromethyl-pyrimidines. Bioorg Med Chem 16:10236-43 (2008) [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:
BDBM50246507
Synonyms:
2-(N'-4-Nitro-benzylidenehydrazino)-4-trifluoromethylpyrimidine | CHEMBL453633
Type:
Small organic molecule
Emp. Form.:
C12H8F3N5O2
Mol. Mass.:
311.2194
SMILES:
[O-][N+](=O)c1ccc(CN=Nc2nccc(n2)C(F)(F)F)cc1 |w:9.9|
Structure:
Search PDB for entries with ligand similarity: