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BDBM50003986 CHEMBL3236107

SMILES: COc1ccc(cn1)N1C[C@H](CN)[C@H](CC1=O)c1cc(F)ccc1F

InChI Key: InChIKey=NKEXHLNBBIIVHY-FZMZJTMJSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50003986   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50003986
PNG
(CHEMBL3236107)
Show SMILES COc1ccc(cn1)N1C[C@H](CN)[C@H](CC1=O)c1cc(F)ccc1F |r|
Show InChI InChI=1S/C18H19F2N3O2/c1-25-17-5-3-13(9-22-17)23-10-11(8-21)14(7-18(23)24)15-6-12(19)2-4-16(15)20/h2-6,9,11,14H,7-8,10,21H2,1H3/t11-,14-/m0/s1
PDB
MMDB

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Similars

Article
PubMed
n/an/a 452n/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