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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 = 'BDBM50399724'   
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))
BDBM50399724
PNG
(CHEMBL2178973)
Show SMILES O=C(CCCc1ccccc1)N1C[C@H](C[C@H]1C(=O)N1CCCC1)n1cc(CN2CCOCC2)nn1 |r|
Show InChI InChI=1S/C26H36N6O3/c33-25(10-6-9-21-7-2-1-3-8-21)31-20-23(17-24(31)26(34)30-11-4-5-12-30)32-19-22(27-28-32)18-29-13-15-35-16-14-29/h1-3,7-8,19,23-24H,4-6,9-18,20H2/t23-,24-/m0/s1
PDB
MMDB

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Similars

Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of human seminal plasma DPP4 assessed as pNA release from Gly-Pro-p-nitroanilide substrate pre-incubated with enzyme for 15 min prior to s...


J Med Chem 55: 9856-67 (2012)


Article DOI: 10.1021/jm301060g
BindingDB Entry DOI: 10.7270/Q2SN0B3S
More data for this
Ligand-Target Pair