Reaction Details | |||
---|---|---|---|
Report a problem with these data | |||
Target | Dipeptidyl peptidase 8 | ||
Ligand | BDBM50221979 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_449744 (CHEMBL898849) | ||
IC50 | 53000±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: |
| ||
BDBM50221979 | |||
n/a | |||
Name | BDBM50221979 | ||
Synonyms: | (2S,3S)-2-((1r,4S)-4-([1,2,4]triazolo[1,5-a]pyridin-5-yl)cyclohexyl)-3-amino-4-((S)-3-fluoropyrrolidin-1-yl)-N,N-dimethyl-4-oxobutanamide | (2S,3S)-3-AMINO-4-[(3S)-3-FLUOROPYRROLIDIN-1-YL]-N,N-DIMETHYL-4-OXO-2-(TRANS-4-[1,2,4]TRIAZOLO[1,5-A]PYRIDIN-5-YLCYCLOHEXYL)BUTANAMIDE | CHEMBL400841 | ||
Type | Small organic molecule | ||
Emp. Form. | C22H31FN6O2 | ||
Mol. Mass. | 430.5189 | ||
SMILES | CN(C)C(=O)[C@H]([C@H](N)C(=O)N1CC[C@H](F)C1)[C@H]1CC[C@@H](CC1)c1cccc2ncnn12 |wU:6.6,16.22,wD:5.4,19.23,13.13,(21.85,6.14,;21.85,4.6,;20.52,3.82,;23.19,3.83,;24.52,4.61,;23.2,2.29,;24.53,1.53,;24.54,-.01,;25.86,2.3,;25.86,3.84,;27.2,1.54,;28.61,2.17,;29.64,1.03,;28.88,-.31,;29.51,-1.71,;27.37,.01,;21.86,1.52,;21.87,-.03,;20.53,-.8,;19.2,-.04,;19.2,1.51,;20.53,2.28,;17.86,-.8,;16.53,-.03,;15.2,-.8,;15.2,-2.34,;16.54,-3.12,;16.88,-4.62,;18.41,-4.77,;19.02,-3.36,;17.87,-2.34,)| | ||
Structure |