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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dipeptidyl peptidase 8' and Ligand = 'BDBM50210672'   
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 8


(Homo sapiens (Human))
BDBM50210672
PNG
((R)-3-amino-4-(2,5-difluorophenyl)-1-(3-(4-fluorop...)
Show SMILES N[C@@H](CC(=O)N1CCn2c(C1)nnc2-c1ccc(F)cc1)Cc1cc(F)ccc1F
Show InChI InChI=1S/C21H20F3N5O/c22-15-3-1-13(2-4-15)21-27-26-19-12-28(7-8-29(19)21)20(30)11-17(25)10-14-9-16(23)5-6-18(14)24/h1-6,9,17H,7-8,10-12,25H2/t17-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 979n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of DPP8 activity


Bioorg Med Chem Lett 17: 3373-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.098
BindingDB Entry DOI: 10.7270/Q2W37W04
More data for this
Ligand-Target Pair