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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 = 'BDBM50004120'   
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))
BDBM50004120
PNG
(CHEMBL3236130)
Show SMILES NC[C@H]1CN(C(=O)C[C@@H]1c1ccc(Cl)cc1Cl)c1ccc2nc(nn2n1)C(F)(F)F |r|
Show InChI InChI=1S/C18H15Cl2F3N6O/c19-10-1-2-11(13(20)5-10)12-6-16(30)28(8-9(12)7-24)15-4-3-14-25-17(18(21,22)23)27-29(14)26-15/h1-5,9,12H,6-8,24H2/t9-,12-/m0/s1
PDB
MMDB

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Similars

Article
PubMed
n/an/a 137n/an/an/an/an/an/a



M.S. University of Baroda

Curated by ChEMBL


Assay Description
Inhibition of human DPP-4 expressed in baculovirus expression system using H-Gly-Pro-AMC as substrate after 30 mins by fluorometric analysis


Bioorg Med Chem Lett 24: 1918-22 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.009
BindingDB Entry DOI: 10.7270/Q2G73G7F
More data for this
Ligand-Target Pair