Reaction Details Report a problem with these data
Target
Cathepsin S
Ligand
BDBM41331
Substrate
n/a
Meas. Tech.
Cathepsin S dose-response confirmation
IC50
3791.38±79.4868 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:
BDBM41331
Synonyms:
MLS000092504 | N-[2-(dipropylamino)ethyl]-2-[(2-keto-3,4-dihydro-1H-quinolin-6-yl)sulfonylamino]-2-phenyl-acetamide | N-[2-(dipropylamino)ethyl]-2-[(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)sulfonylamino]-2-phenyl-ethanamide | N-[2-(dipropylamino)ethyl]-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)sulfonylamino]-2-phenylacetamide | N-[2-(dipropylamino)ethyl]-2-{[(2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)sulfonyl]amino}-2-phenylacetamide | SMR000028054 | cid_3245121
Type:
Small organic molecule
Emp. Form.:
C25H34N4O4S
Mol. Mass.:
486.627
SMILES:
CCCN(CCC)CCNC(=O)C(NS(=O)(=O)c1ccc2NC(=O)CCc2c1)c1ccccc1
Structure:
Search PDB for entries with ligand similarity: