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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Dipeptidyl peptidase 1 | ||
| Ligand | BDBM138501 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | Inhibition Assay | ||
| Temperature | 298.15±n/a K | ||
| IC50 | 97.4±n/a nM | ||
| Comments | extracted | ||
| Citation |  Anderskewitz, R; Grauert, M; Grundl, M; Oost, T; Pautsch, A; Peters, S Method of using substituted 2-Aza-bicyclo[2.2.2]octane-3-carboxylic acid (benzyl-cyano-methyl)-amides inhibitors of cathepsin C US Patent US9073869 Publication Date 7/7/2015 | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Dipeptidyl peptidase 1 | |||
| Name: | Dipeptidyl peptidase 1 | ||
| Synonyms: | CATC_HUMAN | CPPI | CTSC | Cathepsin C | Cathepsin J | Dipeptidyl peptidase 1 (DDPI) | Dipeptidyl peptidase 1 (DPPI) | Dipeptidyl peptidase I | Dipeptidyl peptidase I (DPPI) | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 51857.28 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P53634 | ||
| Residue: | 463 | ||
| Sequence: |
| ||
| BDBM138501 | |||
| n/a | |||
| Name | BDBM138501 | ||
| Synonyms: | US8877775, 12 | US9073869, 12 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C24H28N4O3S | ||
| Mol. Mass. | 452.569 | ||
| SMILES | CS(=O)(=O)Nc1cccc(c1)-c1ccc(C[C@H](NC(=O)[C@H]2NC3CCC2CC3)C#N)cc1 |r,wU:20.20,wD:16.17,(5.44,-6.83,;4.67,-5.49,;3.33,-6.26,;3.9,-4.16,;6,-4.72,;6,-3.18,;7.34,-2.41,;7.34,-.87,;6,-.1,;4.67,-.87,;4.67,-2.41,;3.33,-.1,;2,-.87,;.67,-.1,;.67,1.44,;-.67,2.21,;-.67,3.75,;-2,4.52,;-3.33,3.75,;-3.33,2.21,;-4.67,4.52,;-6,3.75,;-7.34,4.52,;-7.34,6.06,;-6,6.83,;-4.67,6.06,;-5.44,4.72,;-6.57,5.85,;.67,4.52,;2,5.29,;2,2.21,;3.33,1.44,)| | ||
| Structure | 
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