Reaction Details Report a problem with these data
Target
Cathepsin D
Ligand
BDBM50040389
Substrate
n/a
Meas. Tech.
ChEMBL_44978 (CHEMBL660139)
IC50
>10000±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
More Info.:
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:
BDBM50040389
Synonyms:
(2R,3S)-4-Cyclohexyl-2-hydroxy-3-{(S)-2-[hydroxy-(3-phenyl-propyl)-phosphinoyloxy]-hexanoylamino}-butyric acid isopropyl ester | CHEMBL148625
Type:
Small organic molecule
Emp. Form.:
C28H46NO7P
Mol. Mass.:
539.6411
SMILES:
CCCC[C@H](OP(O)(=O)CCCc1ccccc1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)C(=O)OC(C)C