Reaction Details Report a problem with these data
Target
Trophozoite cysteine proteinase
Ligand
BDBM50486842
Substrate
n/a
Meas. Tech.
ChEMBL_903031 (CHEMBL3063284)
IC50
1700±n/a nM
Citation
  TBA Med Chem Res 21:3835-3847 (2012)    Article 
Target
Name:
Trophozoite cysteine proteinase
Synonyms:
3.4.22.- | CYSP_PLAFA | TCP | Trophozoite cysteine proteinase
Type:
PROTEIN
Mol. Mass.:
66893.11
Organism:
Plasmodium falciparum
Description:
ChEMBL_106615
Residue:
569
Sequence:
MVAIKEMKELAFARPSLVETLNKKKKFLKKKEKRTFVLSIYAFITFIIFCIGILYFTNKSSAHNNNNNKNEHSLKKEEIELLRVLLEKYKKQKDGILNESSNEEDEEKYTLNSETYNNKNNVSNIKNDSIKSKKEEYINLERILLEKYKKFINENNEENRKELSNILHKLLEINKLILREEKDDKKVYLINDNYDEKGALEIGMNEEMKYKKEDPINNIKYASKFFKFMKEHNKVYKNIDEQMRKFEIFKINYISIKNHNKLNKNAMYKKKVNQFSDYSEEELKEYFKTLLHVPNHMIEKYSKPFENHLKDNILISEFYTNGKRNEKDIFSKVPEILDYREKGIVHEPKDQGLCGSCWAFASVGNIESVFAKKNKNILSFSEQEVVDCSKDNFGCDGGHPFYSFLYVLQNELCLGDEYKYKAKDDMFCLNYRCKRKVSLSSIGAVKENQLILALNEVGPLSVNVGVNNDFVAYSEGVYNGTCSEELNHSVLLVGYGQVEKTKLNYNNKIQTYNTKENSNQPDDNIIYYWIIKNSWSKKWGENGFMRLSRNKNGDNVFCGIGEEVFYPIL
  
Inhibitor
Name:
BDBM50486842
Synonyms:
CHEMBL2237705
Type:
Small organic molecule
Emp. Form.:
C16H15NO3
Mol. Mass.:
269.2952
SMILES:
COc1ccc(\C=C\C(=O)c2ccccn2)c(OC)c1
Structure:
Search PDB for entries with ligand similarity: