Reaction Details Report a problem with these data
Target
Falcipain 2B
Ligand
BDBM50187255
Substrate
n/a
Meas. Tech.
ChEMBL_356421 (CHEMBL867545)
IC50
14010±n/a nM
Citation
 Micale, N; Kozikowski, AP; Ettari, R; Grasso, S; Zappalà, M; Jeong, JJ; Kumar, A; Hanspal, M; Chishti, AH Novel peptidomimetic cysteine protease inhibitors as potential antimalarial agents. J Med Chem 49:3064-7 (2006) [PubMed]  Article 
Target
Name:
Falcipain 2B
Synonyms:
n/a
Type:
PROTEIN
Mol. Mass.:
27119.28
Organism:
Plasmodium falciparum
Description:
ChEMBL_356421
Residue:
241
Sequence:
QINYDAVIKKYKGNENFDHAAYDWRLHSGVTPVKDQKNCGSCWAFSSIGSVESQYAIRKNKLITLSEQELVDCSFKNYGCNGGLINNAFEDMIELGGICTDDDYPYVSDAPNLCNIDRCTEKYGIKNYLSVPDNKLKEALRFLGPISISIAVSDDFPFYKEGIFDGECGDELNHAVMLVGFGMKEIVNPLTKKGEKHYYYIIKNSWGQQWGERGFINIETDESGLMRKCGLGTDAFIPLIE
  
Inhibitor
Name:
BDBM50187255
Synonyms:
4-methoxyphenyl)-carbamic acid 1-[(2-hydroxy-5-oxo-tetrahydro-furan-3(S)-ylcarbamoyl)-methyl]-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3(R)-ylmethyl ester | CHEMBL207117
Type:
Small organic molecule
Emp. Form.:
C30H28N4O8
Mol. Mass.:
572.5653
SMILES:
COc1ccc(NC(=O)OC[C@H]2N=C(c3ccccc3)c3ccccc3N(CC(=O)N[C@H]3CC(=O)OC3O)C2=O)cc1 |t:12|
Structure:
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