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Target
Dipeptidyl peptidase 4 [K6R,T557I]
Ligand
BDBM167936
Substrate
n/a
Meas. Tech.
DPP-IV Inhibition Activity
Temperature
298.1500±n/a K
IC50
73±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:
DPP4_HUMAN | DPP4 | ADCP2 | CD26 | Dipeptidyl peptidase-IV (DDP-4) | Dipeptidyl peptidase IV (DPP-IV) | Dipeptidyl peptidase-IV (DPP-IV)
Type:
Protein
Mol. Mass.:
88325.11
Organism:
Human
Description:
P27487[K6R,T557I]
Residue:
766
Sequence:
MKTPWRVLLGLLGAAALVTIITVPVVLLNKGTDDATADSRKTYTLTDYLKNTYRLKLYSLRWISDHEYLYKQENNILVFNAEYGNSSVFLENSTFDEFGHSINDYSISPDGQFILLEYNYVKQWRHSYTASYDIYDLNKRQLITEERIPNNTQWVTWSPVGHKLAYVWNNDIYVKIEPNLPSYRITWTGKEDIIYNGITDWVYEEEVFSAYSALWWSPNGTFLAYAQFNDTEVPLIEYSFYSDESLQYPKTVRVPYPKAGAVNPTVKFFVVNTDSLSSVTNATSIQITAPASMLIGDHYLCDVTWATQERISLQWLRRIQNYSVMDICDYDESSGRWNCLVARQHIEMSTTGWVGRFRPSEPHFTLDGNSFYKIISNEEGYRHICYFQIDKKDCTFITKGTWEVIGIEALTSDYLYYISNEYKGMPGGRNLYKIQLSDYTKVTCLSCELNPERCQYYSVSFSKEAKYYQLRCSGPGLPLYTLHSSVNDKGLRVLEDNSALDKMLQNVQMPSKKLDFIILNETKFWYQMILPPHFDKSKKYPLLLDVYAGPCSQKADIVFRLNWATYLASTENIIVASFDGRGSGYQGDKIMHAINRRLGTFEVEDQIEAARQFSKMGFVDNKRIAIWGWSYGGYVTSMVLGSGSGVFKCGIAVAPVSRWEYYESVYTERYMGLPTPEDNLDHYRNSTVMSRAENFKQVEYLLIHGTADDNVHFQQSAQISKALVDVGVDFQAMWYTDEDHGIASSTAHQHIYTHMSHFIKQCFSLP
  
Inhibitor
Name:
BDBM167936
Synonyms:
1,5-Dimethyl-2-phenyl-4-(3-(phenylsulfonyl)benzo[4,5]imidazo[1,2-a]pyrimidin-4-yl)-1H-pyrazol-3(2H)-one (14)
Type:
Small organic molecule
Emp. Form.:
n/a
Mol. Mass.:
n/a
SMILES:
Cc1c(-c2c(cnc3nc4ccccc4n23)S(=O)(=O)c2ccccc2)c(=O)n(-c2ccccc2)n1C |(9.96,8.33,;8.42,8.41,;7.45,7.21,;7.85,5.72,;9.34,5.32,;9.74,3.84,;8.65,2.75,;7.16,3.15,;5.87,2.31,;4.67,3.28,;3.15,3.04,;2.18,4.23,;2.73,5.67,;4.26,5.91,;5.22,4.71,;6.76,4.63,;10.43,6.41,;9.34,7.5,;11.52,5.32,;11.52,7.5,;13,7.1,;14.09,8.19,;13.69,9.68,;12.21,10.08,;11.12,8.99,;6.02,7.76,;4.72,6.92,;6.1,9.3,;4.9,10.27,;5.14,11.79,;3.94,12.76,;2.51,12.21,;2.26,10.69,;3.46,9.72,;7.58,9.7,;8.14,11.14,)|
Structure:
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