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Target
Cathepsin D
Ligand
BDBM50297934
Substrate
n/a
Meas. Tech.
ChEMBL_584606 (CHEMBL1059107)
Ki
>5000±n/a nM
Citation
 Wångsell, F; Russo, F; Sävmarker, J; Rosenquist, A; Samuelsson, B; Larhed, M Design and synthesis of BACE-1 inhibitors utilizing a tertiary hydroxyl motif as the transition state mimic. Bioorg Med Chem Lett 19:4711-4 (2009) [PubMed]  Article 
Target
Name:
Cathepsin D
Synonyms:
CATD_HUMAN | CPSD | CTSD | Cathepsin D [Precursor] | Cathepsin D heavy chain | Cathepsin D light chain | Cathepsin D precursor
Type:
Enzyme
Mol. Mass.:
44551.72
Organism:
Homo sapiens (Human)
Description:
Human proCathepsin D (SwissProt accession number P07339) was expressed in Sf9 cells, purified, and autoactivated.
Residue:
412
Sequence:
MQPSSLLPLALCLLAAPASALVRIPLHKFTSIRRTMSEVGGSVEDLIAKGPVSKYSQAVPAVTEGPIPEVLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSSNLWVPSIHCKLLDIACWIHHKYNSDKSSTYVKNGTSFDIHYGSGSLSGYLSQDTVSVPCQSASSASALGGVKVERQVFGEATKQPGITFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDQNIFSFYLSRDPDAQPGGELMLGGTDSKYYKGSLSYLNVTRKAYWQVHLDQVEVASGLTLCKEGCEAIVDTGTSLMVGPVDEVRELQKAIGAVPLIQGEYMIPCEKVSTLPAITLKLGGKGYKLSPEDYTLKVSQAGKTLCLSGFMGMDIPPPSGPLWILGDVFIGRYYTVFDRDNNRVGFAEAARL
  
Inhibitor
Name:
BDBM50297934
Synonyms:
2-Hydroxy-2-phenethyl-pentanedioic acid 1-[((1S,2R)-2-hydroxy-indan-1-yl)-amide]5-{[3-(methanesulfonyl-methyl-amino)-5-((R)-1-phenyl-ethylcarbamoyl)-phenyl] -amide} | 2-Hydroxy-2-phenethyl-pentanedioic acid 1-[((1S,2R)-2-hydroxy-indan-1-yl)-amide]5-{[3-(methanesulfonyl-methyl-amino)-5-((R)-1-phenyl-ethylcarbamoyl)-phenyl]-amide} | CHEMBL554781
Type:
Small organic molecule
Emp. Form.:
C39H44N4O7S
Mol. Mass.:
712.854
SMILES:
C[C@@H](NC(=O)c1cc(NC(=O)CCC(O)(CCc2ccccc2)C(=O)N[C@@H]2[C@H](O)Cc3ccccc23)cc(c1)N(C)S(C)(=O)=O)c1ccccc1 |r|
Structure:
Search PDB for entries with ligand similarity: