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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 = 'BDBM50102865'   
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))
BDBM50102865
PNG
(CHEMBL3329627)
Show SMILES Cn1c2nccc(N3CCC[C@@H](N)C3)c2n(Cc2ccccc2C#N)c1=O |r|
Show InChI InChI=1S/C20H22N6O/c1-24-19-18(17(8-9-23-19)25-10-4-7-16(22)13-25)26(20(24)27)12-15-6-3-2-5-14(15)11-21/h2-3,5-6,8-9,16H,4,7,10,12-13,22H2,1H3/t16-/m1/s1
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Similars

Article
PubMed
n/an/a 13n/an/an/an/an/an/a



XuanZhu Pharma

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP4 pre-incubated with compound for 15 mins before substrate addition by luminescence assay


ACS Med Chem Lett 5: 921-6 (2014)


Article DOI: 10.1021/ml5001905
BindingDB Entry DOI: 10.7270/Q2N29ZQM
More data for this
Ligand-Target Pair