Reaction Details Report a problem with these data
Target
Cathepsin S
Ligand
BDBM41287
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:
BDBM41287
Synonyms:
1-(3-Amino-propyl)-5-methyl-1H-indole-2,3-dicarboxylic acid dimethyl ester | 1-(3-aminopropyl)-5-methyl-indole-2,3-dicarboxylic acid dimethyl ester;hydrochloride | 1-(3-aminopropyl)-5-methylindole-2,3-dicarboxylic acid dimethyl ester;hydrochloride | MLS000035145 | SMR000011712 | cid_6602610 | dimethyl 1-(3-aminopropyl)-5-methylindole-2,3-dicarboxylate;hydrochloride | dimethyl 1-(3-azanylpropyl)-5-methyl-indole-2,3-dicarboxylate;hydrochloride
Type:
Small organic molecule
Emp. Form.:
C16H20N2O4
Mol. Mass.:
304.341
SMILES:
COC(=O)c1c(C(=O)OC)c2cc(C)ccc2n1CCCN
Structure:
Search PDB for entries with ligand similarity: