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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 = 'BDBM50187298'   
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))
BDBM50187298
PNG
((2R,5S)-1-(2-(1-(cyclohexyloxymethyl)cyclopentylam...)
Show SMILES O=C(CNC1(COC2CCCCC2)CCCC1)N1[C@@H](CC[C@@H]1C#N)C#N
Show InChI InChI=1S/C20H30N4O2/c21-12-16-8-9-17(13-22)24(16)19(25)14-23-20(10-4-5-11-20)15-26-18-6-2-1-3-7-18/h16-18,23H,1-11,14-15H2/t16-,17+
PDB
MMDB

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Similars

Article
PubMed
n/an/a 702n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4


J Med Chem 49: 3068-76 (2006)


Article DOI: 10.1021/jm0600085
BindingDB Entry DOI: 10.7270/Q2BG2NM7
More data for this
Ligand-Target Pair