Reaction Details Report a problem with these data
Target
Papain
Ligand
BDBM50359635
Substrate
n/a
Meas. Tech.
ChEMBL_792720 (CHEMBL1930547)
IC50
>50000±n/a nM
Citation
 Glória, PM; Gut, J; Gonçalves, LM; Rosenthal, PJ; Moreira, R; Santos, MM Aza vinyl sulfones: synthesis and evaluation as antiplasmodial agents. Bioorg Med Chem 19:7635-42 (2011) [PubMed]  Article 
Target
Name:
Papain
Synonyms:
Allergen=Car p 1 | PAPA1_CARPA | PPI | Papaya proteinase I
Type:
Enzyme
Mol. Mass.:
38923.01
Organism:
Carica papaya
Description:
Papain was purchased from Sigma, Germany.
Residue:
345
Sequence:
MAMIPSISKLLFVAICLFVYMGLSFGDFSIVGYSQNDLTSTERLIQLFESWMLKHNKIYKNIDEKIYRFEIFKDNLKYIDETNKKNNSYWLGLNVFADMSNDEFKEKYTGSIAGNYTTTELSYEEVLNDGDVNIPEYVDWRQKGAVTPVKNQGSCGSCWAFSAVVTIEGIIKIRTGNLNEYSEQELLDCDRRSYGCNGGYPWSALQLVAQYGIHYRNTYPYEGVQRYCRSREKGPYAAKTDGVRQVQPYNEGALLYSIANQPVSVVLEAAGKDFQLYRGGIFVGPCGNKVDHAVAAVGYGPNYILIKNSWGTGWGENGYIRIKRGTGNSYGVCGLYTSSFYPVKN
  
Inhibitor
Name:
BDBM50359635
Synonyms:
CHEMBL1928656
Type:
Small organic molecule
Emp. Form.:
C27H27N3O6S
Mol. Mass.:
521.585
SMILES:
O=C(CNC(=O)OCc1ccccc1)NN(CCc1ccccc1)C(=O)C=CS(=O)(=O)c1ccccc1 |w:26.27|
Structure:
Search PDB for entries with ligand similarity: