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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 = 'BDBM50129911'   
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))
BDBM50129911
PNG
(1-{2-[2-(5-Trifluoromethyl-pyridin-2-ylamino)-ethy...)
Show SMILES FC(F)(F)c1ccc(NCCNCC(=O)N2CCC[C@H]2C#N)nc1
Show InChI InChI=1S/C15H18F3N5O/c16-15(17,18)11-3-4-13(22-9-11)21-6-5-20-10-14(24)23-7-1-2-12(23)8-19/h3-4,9,12,20H,1-2,5-7,10H2,(H,21,22)/t12-/m0/s1
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MMDB

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Article
PubMed
n/an/a 83n/an/an/an/an/an/a



Novartis Institute for Biomedical Research

Curated by ChEMBL


Assay Description
Inhibition of human dipeptidyl peptidase IV (DPP IV) obtained from human colonic carcinoma cells


J Med Chem 46: 2774-89 (2003)


Article DOI: 10.1021/jm030091l
BindingDB Entry DOI: 10.7270/Q20001HR
More data for this
Ligand-Target Pair