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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 = 'BDBM50335779'   
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))
BDBM50335779
PNG
((+/-)2-{6-[3((+/-)-Aminoazepan-1-yl]-3-methyl-2,4-...)
Show SMILES Cn1c(=O)cc(N2CCCCC(N)C2)n(Cc2ccccc2C#N)c1=O
Show InChI InChI=1S/C19H23N5O2/c1-22-18(25)10-17(23-9-5-4-8-16(21)13-23)24(19(22)26)12-15-7-3-2-6-14(15)11-20/h2-3,6-7,10,16H,4-5,8-9,12-13,21H2,1H3
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Article
PubMed
n/an/a 3.80E+3n/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