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Target
Dipeptidyl peptidase 4 [K6R,T557I]
Ligand
BDBM167939
Substrate
n/a
Meas. Tech.
DPP-IV Inhibition Activity
Temperature
298.15±n/a K
IC50
1637±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:
BDBM167939
Synonyms:
1',5'-Dimethyl-2,2'-diphenyl-5-(phenylsulfonyl)-1'H,2H-[3,4'-bipyrazol]-3'(2'H)-one (19)
Type:
Small organic molecule
Emp. Form.:
C26H22N4O3S
Mol. Mass.:
470.543
SMILES:
Cc1c(-c2cc(nn2-c2ccccc2)S(=O)(=O)c2ccccc2)c(=O)n(-c2ccccc2)n1C |(4.04,-11.23,;2.58,-10.76,;2.1,-9.29,;3.01,-8.05,;2.53,-6.58,;3.78,-5.68,;5.02,-6.58,;4.55,-8.05,;5.45,-9.29,;6.99,-9.13,;7.89,-10.38,;7.26,-11.78,;5.73,-11.94,;4.83,-10.7,;3.78,-4.14,;2.24,-4.14,;5.32,-4.14,;3.78,-2.6,;2.45,-1.83,;2.45,-.29,;3.78,.48,;5.11,-.29,;5.11,-1.83,;.56,-9.29,;-.34,-8.05,;.09,-10.76,;-1.38,-11.23,;-1.7,-12.74,;-3.16,-13.21,;-4.31,-12.18,;-3.99,-10.68,;-2.52,-10.2,;1.33,-11.66,;1.33,-13.2,)|
Structure:
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