Target
Cruzipain
Ligand
BDBM50017657
Substrate
n/a
Meas. Tech.
ChEMBL_635149 (CHEMBL1119971)
IC50
124000±n/a nM
Citation
 Doak, AKWille, HPrusiner, SBShoichet, BK Colloid formation by drugs in simulated intestinal fluid. J Med Chem 53:4259-65 (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:
BDBM50017657
Synonyms:
1-(Diphenylmethyl)-4-(3-phenyl-2-propenyl)piperazine | 1-(diphenylmethyl)-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine | 1-Benzhydryl-4-cinnamylpiperazin | 1-Cinnamyl-4-(diphenylmethyl)piperazine | CHEMBL43064 | cid_1547484 | cinnarizine
Type:
Small organic molecule
Emp. Form.:
C26H28N2
Mol. Mass.:
368.5139
SMILES:
C(\C=C\c1ccccc1)N1CCN(CC1)C(c1ccccc1)c1ccccc1
Structure:
Search PDB for entries with ligand similarity: