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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dipeptidyl peptidase 4' and Ligand = 'BDBM50337758'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50337758
PNG
(2-(3-((R)-3-amino-4-(2,4,5-trifluorophenyl)butanoy...)
Show SMILES N[C@@H](CC(=O)N1CCSC1C(=O)NCC(O)=O)Cc1cc(F)c(F)cc1F |r|
Show InChI InChI=1S/C16H18F3N3O4S/c17-10-6-12(19)11(18)4-8(10)3-9(20)5-13(23)22-1-2-27-16(22)15(26)21-7-14(24)25/h4,6,9,16H,1-3,5,7,20H2,(H,21,26)(H,24,25)/t9-,16?/m1/s1
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Similars

Article
PubMed
n/an/a 212n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4 after 60 mins by fluorescence plate reader


Bioorg Med Chem Lett 21: 1366-70 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.041
BindingDB Entry DOI: 10.7270/Q25B02R9
More data for this
Ligand-Target Pair