Comparing the applications of machine learning, PBPK, and population pharmacokinetic models in pharmacokinetic drug–drug interaction prediction
J Gill, M Moullet, A Martinsson… - CPT …, 2022 - Wiley Online Library
The gold‐standard approach for modeling pharmacokinetic mediated drug–drug
interactions is the use of physiologically‐based pharmacokinetic modeling and population …
interactions is the use of physiologically‐based pharmacokinetic modeling and population …
Evaluating the performance of machine‐learning regression models for pharmacokinetic drug–drug interactions
J Gill, M Moullet, A Martinsson… - CPT …, 2023 - Wiley Online Library
Combination therapy or concomitant drug administration can be associated with
pharmacokinetic drug–drug interactions, increasing the risk of adverse drug events and …
pharmacokinetic drug–drug interactions, increasing the risk of adverse drug events and …
Adapting physiologically-based pharmacokinetic models for machine learning applications
S Habiballah, B Reisfeld - Scientific Reports, 2023 - nature.com
Both machine learning and physiologically-based pharmacokinetic models are becoming
essential components of the drug development process. Integrating the predictive …
essential components of the drug development process. Integrating the predictive …
[HTML][HTML] Reviewing data integrated for PBPK model development to predict metabolic drug-drug interactions: shifting perspectives and emerging trends
K Abouir, CF Samer, Y Gloor, JA Desmeules… - Frontiers in …, 2021 - frontiersin.org
Physiologically-based pharmacokinetics (PBPK) modeling is a robust tool that supports drug
development and the pharmaceutical industry and regulatory authorities. Implementation of …
development and the pharmaceutical industry and regulatory authorities. Implementation of …
Can we predict clinical pharmacokinetics of highly lipophilic compounds by integration of machine learning or in vitro data into physiologically based models? A …
N Parrott, N Manevski… - Molecular …, 2022 - ACS Publications
While high lipophilicity tends to improve potency, its effects on pharmacokinetics (PK) are
complex and often unfavorable. To predict clinical PK in early drug discovery, we built …
complex and often unfavorable. To predict clinical PK in early drug discovery, we built …
Computational predictions of nonclinical pharmacokinetics at the drug design stage
R Stoyanova, PM Katzberger… - Journal of Chemical …, 2023 - ACS Publications
Although computational predictions of pharmacokinetics (PK) are desirable at the drug
design stage, existing approaches are often limited by prediction accuracy and human …
design stage, existing approaches are often limited by prediction accuracy and human …
Modeling drug disposition and drug–drug interactions through hypothesis-driven physiologically based pharmacokinetics: a reversal translation perspective
GF Li, QS Zheng - European Journal of Drug Metabolism and …, 2018 - Springer
A crucial feature of physiologically based pharmacokinetic (PBPK) modeling is the ability to
separate compound-dependent properties from population-dependent properties, enabling …
separate compound-dependent properties from population-dependent properties, enabling …
Application of PBPK modelling in drug discovery and development at Pfizer
HM Jones, M Dickins, K Youdim, JR Gosset… - Xenobiotica, 2012 - Taylor & Francis
Early prediction of human pharmacokinetics (PK) and drug–drug interactions (DDI) in drug
discovery and development allows for more informed decision making. Physiologically …
discovery and development allows for more informed decision making. Physiologically …
Use of physiologically based pharmacokinetic modeling for assessment of drug–drug interactions
G Baneyx, Y Fukushima, N Parrott - Future Medicinal Chemistry, 2012 - Future Science
Interactions between co-administered medicines can reduce efficacy or lead to adverse
effects. Understanding and managing such interactions is essential in bringing safe and …
effects. Understanding and managing such interactions is essential in bringing safe and …
Physiologically based pharmacokinetic (PBPK) modeling and simulation approaches: a systematic review of published models, applications, and model verification
JE Sager, J Yu, I Ragueneau-Majlessi… - Drug Metabolism and …, 2015 - ASPET
Modeling and simulation of drug disposition has emerged as an important tool in drug
development, clinical study design and regulatory review, and the number of physiologically …
development, clinical study design and regulatory review, and the number of physiologically …
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