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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 = 'BDBM50374941'   
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))
BDBM50374941
PNG
(CHEMBL445674)
Show SMILES [#6]S(=O)(=O)c1ccc(-c2noc(n2)-[#6@@H](-[#6]-[#6]-[#8])-[#6@H](-[#7])-[#6](\F)=[#6]-2/[#6]-[#6]-[#6]-[#6]-2)c(Cl)c1 |r|
Show InChI InChI=1S/C19H23ClFN3O4S/c1-29(26,27)12-6-7-13(15(20)10-12)18-23-19(28-24-18)14(8-9-25)17(22)16(21)11-4-2-3-5-11/h6-7,10,14,17,25H,2-5,8-9,22H2,1H3/t14-,17-/m0/s1
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Similars

Article
PubMed
n/an/a 3.20n/an/an/an/an/an/a



Merck& Co. Inc.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4 expressed in insect cell


Bioorg Med Chem Lett 18: 2409-13 (2008)


Article DOI: 10.1016/j.bmcl.2008.02.050
BindingDB Entry DOI: 10.7270/Q2HD7WJ0
More data for this
Ligand-Target Pair