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TargetCathepsin S
LigandBDBM50320057
Substrate/Competitorn/a
Meas. Tech.ChEMBL_635108
IC50 2.3±n/a nM
Citation Chen, JCUang, BJLyu, PCChang, JYLiu, KJKuo, CCHsieh, HPWang, HCCheng, CSChang, YHChang, MDChang, WSLin, CC Design and synthesis of alpha-ketoamides as cathepsin S inhibitors with potential applications against tumor invasion and angiogenesis. J Med Chem53:4545-9 (2010) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Cathepsin S
Name:Cathepsin S
Synonyms:CTSS | Cathepsin S (Cat S) | cathepsin S preproprotein
Type:Protein
Mol. Mass.:37507.38
Organism:Homo sapiens (Human)
Description:P25774
Residue:331
Sequence:
MKRLVCVLLVCSSAVAQLHKDPTLDHHWHLWKKTYGKQYKEKNEEAVRRLIWEKNLKFVM
LHNLEHSMGMHSYDLGMNHLGDMTSEEVMSLMSSLRVPSQWQRNITYKSNPNRILPDSVD
WREKGCVTEVKYQGSCGACWAFSAVGALEAQLKLKTGKLVSLSAQNLVDCSTEKYGNKGC
NGGFMTTAFQYIIDNKGIDSDASYPYKAMDQKCQYDSKYRAATCSKYTELPYGREDVLKE
AVANKGPVSVGVDARHPSFFLYRSGVYYEPSCTQNVNHGVLVVGYGDLNGKEYWLVKNSW
GHNFGEEGYIRMARNKGNHCGIASFPSYPEI
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50320057
NameBDBM50320057
Synonyms:CHEMBL1083620 | ethyl 2-(4-(benzyloxy)-3-((S)-2-(5-bromofuran-2-carboxamido)-3-cyclohexylpropanamido)-2-oxobutanamido)acetate
TypeSmall organic molecule
Emp. Form.C29H36BrN3O8
Mol. Mass.634.515
SMILESCCOC(=O)CNC(=O)C(=O)C(COCc1ccccc1)NC(=O)[C@H](CC1CCCCC1)NC(=O)c1ccc(Br)o1 |r|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least:
n/a