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Target
Dipeptidyl peptidase 4 [K6R,T557I]
Ligand
BDBM167937
Substrate
n/a
Meas. Tech.
DPP-IV Inhibition Activity
Temperature
298.15±n/a K
IC50
14494±0.0 nM
Comments
extracted
Citation
 Gomha, SM; Eldebss, TM; Badrey, MG; Abdulla, MM; Mayhoub, AS Novel 4-heteroaryl-antipyrines as DPP-IV inhibitors. Chem Biol Drug Des 86:1292-303 (2015) [PubMed]  Article 
Target
Name:
Dipeptidyl peptidase 4 [K6R,T557I]
Synonyms:
ADCP2 | CD26 | DPP4 | DPP4_HUMAN | Dipeptidyl peptidase IV (DPP-IV) | Dipeptidyl peptidase-IV (DDP-4) | Dipeptidyl peptidase-IV (DPP-IV)
Type:
Protein
Mol. Mass.:
88325.11
Organism:
Homo sapiens (Human)
Description:
P27487[K6R,T557I]
Residue:
766
Sequence:
MKTPWRVLLGLLGAAALVTIITVPVVLLNKGTDDATADSRKTYTLTDYLKNTYRLKLYSLRWISDHEYLYKQENNILVFNAEYGNSSVFLENSTFDEFGHSINDYSISPDGQFILLEYNYVKQWRHSYTASYDIYDLNKRQLITEERIPNNTQWVTWSPVGHKLAYVWNNDIYVKIEPNLPSYRITWTGKEDIIYNGITDWVYEEEVFSAYSALWWSPNGTFLAYAQFNDTEVPLIEYSFYSDESLQYPKTVRVPYPKAGAVNPTVKFFVVNTDSLSSVTNATSIQITAPASMLIGDHYLCDVTWATQERISLQWLRRIQNYSVMDICDYDESSGRWNCLVARQHIEMSTTGWVGRFRPSEPHFTLDGNSFYKIISNEEGYRHICYFQIDKKDCTFITKGTWEVIGIEALTSDYLYYISNEYKGMPGGRNLYKIQLSDYTKVTCLSCELNPERCQYYSVSFSKEAKYYQLRCSGPGLPLYTLHSSVNDKGLRVLEDNSALDKMLQNVQMPSKKLDFIILNETKFWYQMILPPHFDKSKKYPLLLDVYAGPCSQKADIVFRLNWATYLASTENIIVASFDGRGSGYQGDKIMHAINRRLGTFEVEDQIEAARQFSKMGFVDNKRIAIWGWSYGGYVTSMVLGSGSGVFKCGIAVAPVSRWEYYESVYTERYMGLPTPEDNLDHYRNSTVMSRAENFKQVEYLLIHGTADDNVHFQQSAQISKALVDVGVDFQAMWYTDEDHGIASSTAHQHIYTHMSHFIKQCFSLP
  
Inhibitor
Name:
BDBM167937
Synonyms:
4-(8,10-Dimethyl-3-(phenylsulfonyl)pyrido[2',3':3,4]pyrazolo[1,5-a]pyrimidin-4-yl)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one (15)
Type:
Small organic molecule
Emp. Form.:
C28H24N6O3S
Mol. Mass.:
524.594
SMILES:
Cc1c(-c2c(cnc3c4c(C)cc(C)nc4nn23)S(=O)(=O)c2ccccc2)c(=O)n(-c2ccccc2)n1C |(-1.25,12.4,;.29,12.4,;1.19,11.15,;.72,9.69,;1.75,8.55,;1.27,7.08,;-.23,6.76,;-1.27,7.91,;-2.81,7.91,;-3.84,6.76,;-3.36,5.3,;-5.34,7.08,;-5.82,8.55,;-7.32,8.87,;-4.79,9.69,;-3.28,9.37,;-2.04,10.28,;-.79,9.37,;3.25,8.87,;3.61,7.37,;2.89,10.36,;4.74,9.26,;5.83,8.18,;7.32,8.57,;7.72,10.06,;6.63,11.15,;5.14,10.75,;2.66,11.63,;3.9,10.73,;2.66,13.17,;3.9,14.08,;5.31,13.45,;6.56,14.35,;6.4,15.89,;4.99,16.51,;3.74,15.61,;1.19,13.65,;.72,15.11,)|
Structure:
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