Reaction Details Report a problem with these data
Target
Falcipain 2B
Ligand
BDBM50187252
Substrate
n/a
Meas. Tech.
ChEMBL_356421 (CHEMBL867545)
IC50
19790±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:
BDBM50187252
Synonyms:
CHEMBL377557 | phenyl-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
Type:
Small organic molecule
Emp. Form.:
C29H26N4O7
Mol. Mass.:
542.5393
SMILES:
OC1OC(=O)C[C@@H]1NC(=O)CN1c2ccccc2C(=N[C@H](COC(=O)Nc2ccccc2)C1=O)c1ccccc1 |c:20|
Structure:
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