| Reaction Details |
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 | Report a problem with these data |
| Target | Cathepsin D |
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| Ligand | BDBM50012256 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEBML_44985 |
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| IC50 | >1000±n/a nM |
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| Citation |  Repine, JT; Himmelsbach, RJ; Hodges, JC; Kaltenbronn, JS; Sircar, I; Skeean, RW; Brennan, ST; Hurley, TR; Lunney, E; Humblet, CC Renin inhibitors containing esters at the P2-position. Oral activity in a derivative of methyl aminomalonate. J Med Chem34:1935-43 (1991) [PubMed] |
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| More Info.: | Get all data from this article, Assay Method |
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| Cathepsin D |
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| Name: | Cathepsin D |
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| Synonyms: | CATD_BOVIN | CTSD |
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| Type: | PROTEIN |
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| Mol. Mass.: | 42158.92 |
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| Organism: | Bos taurus |
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| Description: | ChEMBL_1458606 |
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| Residue: | 387 |
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| Sequence: | VIRIPLHKFTSIRRTMSEAAGVLIAKGPISKYATGEPAVRQGPIPELLKNYMDAQYYGEI
GIGTPPQCFTVVFDTGSANLWVPSIHCKLLDIACWTHRKYNSDKSSTYVKNGTTFDIHYG
SGSLSGYLSQDTVSVPCNPSSSSPGGVTVQRQTFGEAIKQPGVVFIAAKFDGILGMAYPR
ISVNNVLPVFDNLMQQKLVDKNVFSFFLNRDPKAQPGGELMLGGTDSKYYRGSLMFHNVT
RQAYWQIHMDQLDVGSSLTVCKGGCEAIVDTGTSLIVGPVEEVRELQKAIGAVPLIQGEY
MIPCEKVSSLPEVTVKLGGKDYALSPEDYALKVSQAETTVCLSGFMGMDIPPPGGPLWIL
GDVFIGRYYTVFDRDQNRVGLAEAARL
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| BDBM50012256 |
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| n/a |
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| Name | BDBM50012256 |
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| Synonyms: | CHEMBL431751 | N-{1-[1-Hydroxy-2-(2-morpholin-4-yl-ethylcarbamoyl)-ethyl]-3-methyl-butyl}-2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-malonamic acid methyl ester |
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| Type | Small organic molecule |
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| Emp. Form. | C31H50N6O10S |
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| Mol. Mass. | 698.828 |
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| SMILES | COC(=O)C(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)NCCN1CCOCC1 |
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| Structure | 
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