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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Dipeptidyl peptidase 4 | ||
| Ligand | BDBM50221980 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_449750 (CHEMBL898855) | ||
| IC50 | 820±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 4 | |||
| Name: | Dipeptidyl peptidase 4 | ||
| Synonyms: | ADABP | ADCP2 | Adenosine deaminase complexing protein 2 | CD26 | CD_antigen=CD26 | DPP IV | DPP4 | DPP4_HUMAN | DPPIV | Dipeptidyl peptidase 4 (DDP-IV) | Dipeptidyl peptidase 4 (DPP IV) | Dipeptidyl peptidase 4 (DPP-4) | Dipeptidyl peptidase 4 (DPP4) | Dipeptidyl peptidase 4 (DPPIV) | Dipeptidyl peptidase 4 membrane form | Dipeptidyl peptidase 4 soluble form | Dipeptidyl peptidase IV | Dipeptidyl peptidase IV (DDP-4) | Dipeptidyl peptidase IV (DDP-IV) | Dipeptidyl peptidase IV (DPP IV) | Dipeptidyl peptidase IV membrane form | Dipeptidyl peptidase IV soluble form | Dipeptidyl peptidase-IV (DPP-4) | Dipeptidyl peptidase-IV (DPP-IV) | T-cell activation antigen CD26 | TP103 | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 88271.01 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P27487 | ||
| Residue: | 766 | ||
| Sequence: |
| ||
| BDBM50221980 | |||
| n/a | |||
| Name | BDBM50221980 | ||
| Synonyms: | (2S,3S)-2-((1s,4R)-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 | CHEMBL237566 | ||
| 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:6.6,16.22,19.23,wD:5.4,13.13,(-.72,5.67,;-.72,4.13,;-2.05,3.35,;.62,3.36,;1.95,4.14,;.62,1.82,;1.96,1.06,;1.97,-.48,;3.29,1.83,;3.29,3.37,;4.63,1.07,;6.04,1.7,;7.07,.56,;6.31,-.78,;6.94,-2.18,;4.8,-.46,;-.71,1.05,;-.7,-.5,;-2.04,-1.27,;-3.37,-.5,;-3.37,1.04,;-2.04,1.81,;-4.71,-1.27,;-6.04,-.5,;-7.37,-1.27,;-7.37,-2.81,;-6.03,-3.59,;-5.7,-5.09,;-4.16,-5.24,;-3.55,-3.83,;-4.7,-2.81,)| | ||
| Structure | 
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