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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 = 'BDBM50335782'   
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))
BDBM50335782
PNG
(6-[3-(R)-Aminopiperidin-1-yl]-1-(2-chloro-3,6-difl...)
Show SMILES Cn1c(=O)cc(N2CCC[C@@H](N)C2)n(Cc2c(F)ccc(F)c2Cl)c1=O |r|
Show InChI InChI=1S/C17H19ClF2N4O2/c1-22-15(25)7-14(23-6-2-3-10(21)8-23)24(17(22)26)9-11-12(19)4-5-13(20)16(11)18/h4-5,7,10H,2-3,6,8-9,21H2,1H3/t10-/m1/s1
PDB
MMDB

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Article
PubMed
n/an/a 830n/an/an/an/an/an/a



Takeda San Diego, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human DPP4


J Med Chem 54: 510-24 (2011)


Article DOI: 10.1021/jm101016w
BindingDB Entry DOI: 10.7270/Q24X5828
More data for this
Ligand-Target Pair