Reaction Details Report a problem with these data
Target
Cathepsin S
Ligand
BDBM41336
Substrate
n/a
Meas. Tech.
Cathepsin S dose-response confirmation
IC50
>50000±0 nM
Citation
 PubChem, PC Cathepsin S dose-response confirmation PubChem Bioassay (2008)[AID] 
Target
Name:
Cathepsin S
Synonyms:
CATS_HUMAN | CTSS | Cathepsin S (Cat S) | cathepsin S preproprotein
Type:
Protein
Mol. Mass.:
37507.38
Organism:
Homo sapiens (Human)
Description:
P25774
Residue:
331
Sequence:
MKRLVCVLLVCSSAVAQLHKDPTLDHHWHLWKKTYGKQYKEKNEEAVRRLIWEKNLKFVMLHNLEHSMGMHSYDLGMNHLGDMTSEEVMSLMSSLRVPSQWQRNITYKSNPNRILPDSVDWREKGCVTEVKYQGSCGACWAFSAVGALEAQLKLKTGKLVSLSAQNLVDCSTEKYGNKGCNGGFMTTAFQYIIDNKGIDSDASYPYKAMDQKCQYDSKYRAATCSKYTELPYGREDVLKEAVANKGPVSVGVDARHPSFFLYRSGVYYEPSCTQNVNHGVLVVGYGDLNGKEYWLVKNSWGHNFGEEGYIRMARNKGNHCGIASFPSYPEI
  
Inhibitor
Name:
BDBM41336
Synonyms:
1-[5-(3-hydroxy-3-methyl-but-1-ynyl)thiophene-2-carbonyl]proline | 1-[5-(3-hydroxy-3-methylbut-1-ynyl)thiophene-2-carbonyl]pyrrolidine-2-carboxylic acid | 1-[5-(3-methyl-3-oxidanyl-but-1-ynyl)thiophen-2-yl]carbonylpyrrolidine-2-carboxylic acid | 1-[[5-(3-hydroxy-3-methylbut-1-ynyl)-2-thiophenyl]-oxomethyl]-2-pyrrolidinecarboxylic acid | 1-{[5-(3-hydroxy-3-methyl-1-butyn-1-yl)-2-thienyl]carbonyl}proline | MLS000051204 | SMR000079165 | cid_2965196
Type:
Small organic molecule
Emp. Form.:
C15H17NO4S
Mol. Mass.:
307.365
SMILES:
CC(C)(O)C#Cc1ccc(s1)C(=O)N1CCCC1C(O)=O
Structure:
Search PDB for entries with ligand similarity: