Reaction Details Report a problem with these data
Target
Cathepsin S
Ligand
BDBM41368
Substrate
n/a
Meas. Tech.
Cathepsin S dose-response confirmation
IC50
6893.3±171.22 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:
BDBM41368
Synonyms:
1,5-dimethyl-4-oxidanylidene-N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]pyrrolo[3,2-c]quinoline-2-carboxamide | 1,5-dimethyl-4-oxo-N-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-2-pyrrolo[3,2-c]quinolinecarboxamide | MLS000118133 | N-[2-(4-benzylpiperazin-1-yl)ethyl]-1,5-dimethyl-4-oxopyrrolo[3,2-c]quinoline-2-carboxamide | N-[2-(4-benzylpiperazino)ethyl]-4-keto-1,5-dimethyl-pyrrolo[3,2-c]quinoline-2-carboxamide | SMR000095081 | cid_5308662
Type:
Small organic molecule
Emp. Form.:
C27H31N5O2
Mol. Mass.:
457.5673
SMILES:
Cn1c(cc2c1c1ccccc1n(C)c2=O)C(=O)NCCN1CCN(Cc2ccccc2)CC1
Structure:
Search PDB for entries with ligand similarity: