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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Dipeptidyl peptidase 8 | ||
| Ligand | BDBM50221969 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_449744 (CHEMBL898849) | ||
| IC50 | 22000±n/a nM | ||
| Citation |  Kaelin, DE; Smenton, AL; Eiermann, GJ; He, H; Leiting, B; Lyons, KA; Patel, RA; Patel, SB; Petrov, A; Scapin, G; Wu, JK; Thornberry, NA; Weber, AE; Duffy, JL 4-arylcyclohexylalanine analogs as potent, selective, and orally active inhibitors of dipeptidyl peptidase IV. Bioorg Med Chem Lett17:5806-11 (2007) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Dipeptidyl peptidase 8 | |||
| Name: | Dipeptidyl peptidase 8 | ||
| Synonyms: | DPP8 | DPP8_HUMAN | DPRP-1 | DPRP1 | Dipeptidyl peptidase 8 (DPP-8) | Dipeptidyl peptidase 8 (DPP8) | Dipeptidyl peptidase 8/9 | Dipeptidyl peptidase IV-related protein 1 | Dipeptidyl peptidase VIII | Dipeptidyl peptidase VIII (DDP-VIII) | Prolyl dipeptidase DPP8 | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 103342.62 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | Q6V1X1 | ||
| Residue: | 898 | ||
| Sequence: |
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| BDBM50221969 | |||
| n/a | |||
| Name | BDBM50221969 | ||
| Synonyms: | (2S,3S)-3-amino-4-(3,3-difluoropyrrolidin-1-yl)-N,N-dimethyl-4-oxo-2-((1r,4S)-4-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)cyclohexyl)butanamide | CHEMBL235199 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C22H34F2N6O2 | ||
| Mol. Mass. | 452.5412 | ||
| SMILES | CN(C)C(=O)[C@H]([C@H](N)C(=O)N1CCC(F)(F)C1)[C@H]1CC[C@@H](CC1)C1CCc2ncnn2C1 |w:23.34,wU:6.6,17.23,wD:20.24,5.4,(25.99,-21.91,;25.99,-23.45,;24.66,-24.23,;27.33,-24.22,;28.66,-23.44,;27.33,-25.76,;28.67,-26.52,;28.68,-28.06,;30,-25.75,;29.99,-24.21,;31.34,-26.51,;32.75,-25.88,;33.78,-27.02,;33.02,-28.36,;32.6,-29.84,;34.54,-28.58,;31.51,-28.04,;26,-26.53,;26.01,-28.08,;24.67,-28.85,;23.34,-28.08,;23.34,-26.54,;24.67,-25.77,;22,-28.85,;22.01,-30.39,;20.68,-31.16,;19.34,-30.39,;17.87,-30.87,;16.95,-29.62,;17.86,-28.36,;19.33,-28.84,;20.67,-28.08,)| | ||
| Structure | 
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