Reaction Details Report a problem with these data
Target
Dipeptidyl peptidase 4
Ligand
BDBM224586
Substrate
BDBM224616
Meas. Tech.
DPP-IV Assay
pH
7.8±n/a
IC50
22±n/a nM
Comments
extracted
Citation
 Himmelsbach, F; Langkopf, E; Eckhardt, M; Mark, M; Maier, R; Lotz, R; Tadayyon, M 8-[3-amino-piperidin-1-yl]-xanthines, the preparation thereof and their use as pharmaceutical compositions US Patent  US9321791 Publication Date 4/26/2016 
Target
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:
MKTPWKVLLGLLGAAALVTIITVPVVLLNKGTDDATADSRKTYTLTDYLKNTYRLKLYSLRWISDHEYLYKQENNILVFNAEYGNSSVFLENSTFDEFGHSINDYSISPDGQFILLEYNYVKQWRHSYTASYDIYDLNKRQLITEERIPNNTQWVTWSPVGHKLAYVWNNDIYVKIEPNLPSYRITWTGKEDIIYNGITDWVYEEEVFSAYSALWWSPNGTFLAYAQFNDTEVPLIEYSFYSDESLQYPKTVRVPYPKAGAVNPTVKFFVVNTDSLSSVTNATSIQITAPASMLIGDHYLCDVTWATQERISLQWLRRIQNYSVMDICDYDESSGRWNCLVARQHIEMSTTGWVGRFRPSEPHFTLDGNSFYKIISNEEGYRHICYFQIDKKDCTFITKGTWEVIGIEALTSDYLYYISNEYKGMPGGRNLYKIQLSDYTKVTCLSCELNPERCQYYSVSFSKEAKYYQLRCSGPGLPLYTLHSSVNDKGLRVLEDNSALDKMLQNVQMPSKKLDFIILNETKFWYQMILPPHFDKSKKYPLLLDVYAGPCSQKADTVFRLNWATYLASTENIIVASFDGRGSGYQGDKIMHAINRRLGTFEVEDQIEAARQFSKMGFVDNKRIAIWGWSYGGYVTSMVLGSGSGVFKCGIAVAPVSRWEYYDSVYTERYMGLPTPEDNLDHYRNSTVMSRAENFKQVEYLLIHGTADDNVHFQQSAQISKALVDVGVDFQAMWYTDEDHGIASSTAHQHIYTHMSHFIKQCFSLP
  
Inhibitor
Name:
BDBM224586
Synonyms:
US10202383, Example 2(66) | US9321791, 2(66) | US9556175, 2(66)
Type:
Small organic molecule
Emp. Form.:
C26H34N6O5
Mol. Mass.:
510.5854
SMILES:
[#6]-[#8]-c1cccc(-[#6](=O)-[#6]-n2c(=O)n(-[#6])c3nc(-[#7]-4-[#6]-[#6]-[#6]-[#6](-[#7])-[#6]-4)n(-[#6]\[#6]=[#6](\[#6])-[#6])c3c2=O)c1-[#8]-[#6]
Structure:
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Substrate
Name:
BDBM224616
Synonyms:
US9321791, AFC, Amido-4-trifluoromethylcoumarin
Type:
Substrate
Emp. Form.:
C12H9F3N2O3
Mol. Mass.:
286.2067
SMILES:
NCC(=O)Nc1ccc2c(cc(=O)oc2c1)C(F)(F)F |@:16|
Structure:
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