BDBM126822 US8785477, Sitagliptin

SMILES c1c(c(cc(c1F)F)F)C[C@H](CC(=O)N2CCn3c(nnc3C(F)(F)F)C2)N

InChI Key InChIKey=MFFMDFFZMYYVKS-UHFFFAOYSA-N

Data  3 IC50

PDB links: 3 PDB IDs match this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 126822   

TargetDipeptidyl peptidase 4(Rat)
Shanghai Sun-Sail Pharmaceutical Science & Technology

US Patent
LigandPNGBDBM126822(US8785477, Sitagliptin)
Affinity DataIC50: 26.0nMAssay Description:Thoroughly mixed test compounds, enzyme and reaction buffer, preincubated the mixture for 15 minutes at 37° C. and then primed reaction by adding sub...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/16/2014
Entry Details
Go to US Patent
PDB3D3D Structure (crystal)
TargetDipeptidyl peptidase 4(Human)
Guru Nanak Dev University

Curated by ChEMBL
LigandPNGBDBM126822(US8785477, Sitagliptin)
Affinity DataIC50: 19nMAssay Description:Inhibition of DPP4 (unknown origin) using Gly-Pro-AMC as substrate incubated for 30 mins by fluorescence based enzyme immunoassayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/26/2023
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetDipeptidyl peptidase 4(Human)
Guru Nanak Dev University

Curated by ChEMBL
LigandPNGBDBM126822(US8785477, Sitagliptin)
Affinity DataIC50: 18nMAssay Description:Inhibition of human DPP4 using Gly-Pro-AMC as substrate incubated for 30 mins by continuous fluorescent assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/26/2023
Entry Details
PubMedPDB3D3D Structure (crystal)