Predicting gastric emptying of drug substances taken under postprandial conditions by combination of biorelevant dissolution and mechanistic in silico modeling

Eur J Pharm Sci. 2024 Jul 1:198:106788. doi: 10.1016/j.ejps.2024.106788. Epub 2024 May 3.

Abstract

Physiologically based pharmacokinetic (PBPK) models can help to understand the effects of gastric emptying on pharmacokinetics and in particular also provide a platform for understanding mechanisms of food effects, as well as extrapolation between different postprandial conditions, whether standardized clinical or patient-oriented, non-clinical conditions. By integrating biorelevant dissolution data from the GastroDuo dissolution model into a previously described mechanistic model of fed-state gastric emptying, we simulated the effects of a high-calorie high-fat meal on the pharmacokinetics of sildenafil, febuxostat, acetylsalicylic acid, theobromine and caffeine. The model was able to simulate the variability in Cmax and tmax caused by the presence of the stomach road. The main influences investigated to affect the gastric emptying process were drug solubility (theobromine and caffeine), tablet dissolution rate (acetylsalicylic acid) and sensitivity to gastric motility (sildenafil and febuxostat). Finally, we showed how PBPK models can be used to extrapolate pharmacokinetics between different prandial states using theobromine as an example with results from a clinical study being presented.

Keywords: Fed state; Food effect; Gastric emptying; Magenstrasse; PBPK; Salivary sampling; Stomach road.

MeSH terms

  • Aspirin / administration & dosage
  • Aspirin / chemistry
  • Aspirin / pharmacokinetics
  • Caffeine / administration & dosage
  • Caffeine / chemistry
  • Caffeine / pharmacokinetics
  • Computer Simulation*
  • Drug Liberation
  • Febuxostat / chemistry
  • Febuxostat / pharmacokinetics
  • Gastric Emptying* / physiology
  • Humans
  • Models, Biological*
  • Postprandial Period* / physiology
  • Sildenafil Citrate / chemistry
  • Sildenafil Citrate / pharmacokinetics
  • Solubility*
  • Theobromine / chemistry
  • Theobromine / pharmacokinetics

Substances

  • Febuxostat
  • Theobromine
  • Caffeine
  • Sildenafil Citrate
  • Aspirin