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Target
Cathepsin D
Ligand
BDBM50040394
Substrate
n/a
Meas. Tech.
ChEMBL_44988 (CHEMBL885054)
IC50
2650±n/a nM
Citation
 Raddatz, P; Minck, KO; Rippmann, F; Schmitges, CJ Non-peptide renin inhibitors containing 2-(((3-phenylpropyl)phosphoryl)oxy)alkanoic acid moieties as P2-P3 replacements. J Med Chem 37:486-97 (1994) [PubMed]  Article 
Target
Name:
Cathepsin D
Synonyms:
CATD_BOVIN | CTSD
Type:
PROTEIN
Mol. Mass.:
42158.92
Organism:
Bos taurus
Description:
ChEMBL_1458606
Residue:
387
Sequence:
VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEIGIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYGSGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPRISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVTRQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEYMIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWILGDVFIGRYYTVFDRDQNRVGLAEAARL
  
Inhibitor
Name:
BDBM50040394
Synonyms:
(2R,4S,5S)N-butyl-6-cyclohexyl-4-hydroxy-2-methyl-5-((2R)-2(((benzyloxy)(3-phenylpropyl)phosphoryl)oxy)-hexanamido)hexanamide(less polar) | (2R,4S,5S)N-butyl-6-cyclohexyl-4-hydroxy-2-methyl-5-((2R)-2(((benzyloxy)(3-phenylpropyl)phosphoryl)oxy)-hexanamido)hexanamide(more polar) | CHEMBL146651
Type:
Small organic molecule
Emp. Form.:
C39H59N2O7P
Mol. Mass.:
698.8687
SMILES:
CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCC)OP(=O)(CCCc1ccccc1)OC(=O)c1ccccc1
Structure:
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