网络医学和系统药理学方法用于预测药物的不良影响
Alessio Funari1,2, Giulia Fiscon2,3, Paola Paci2,3
1Department of Translational and Precision Medicine, Sapienza University of Rome, Rome, Italy.
British journal of pharmacology
|September 12, 2024
概括
从分子相互作用中预测药物的副作用是具有挑战性的. 本综述涵盖了计算方法,资源和工具,以帮助预测和管理不良药物事件.
科学领域:
- 药理学和计算化学
- 药物发现和开发 药物发现和开发
背景情况:
- 药物诱导的不良影响是医疗保健的一个重大挑战.
- 了解药物和生物点之间的分子相互作用对于预测副作用至关重要.
- 许多变量使药物诱导不良事件的预测变得复杂.
研究的目的:
- 审查用于预测药物副作用的计算方法.
- 突出这些方法的性能,局限性和应用.
- 为预测副作用提供可用资源的概述.
主要方法:
- 关于计算药物副作用预测现有文献的综述.
- 分析各种预测模型和算法.
- 编制相关数据库和计算工具.
主要成果:
- 计算方法为预测药物的副作用提供了有希望的方法.
- 性能在不同方法之间有所不同,在概括性和准确性方面存在局限.
- 主要资源和数据库可用于支持预测分析.
结论:
- 药物副作用的计算预测是一个不断发展的领域,具有巨大的潜力.
- 需要进一步开发以提高准确性和解决局限性.
- 利用可用的资源可以加强减轻药物不良事件的策略.
相关概念视频
Pharmacovigilance
788
Post-marketing surveillance is a critical component of pharmaceutical regulation, often uncovering unanticipated adverse drug reactions (ADRs) once a drug is widely used over an extended period.
This process, termed pharmacovigilance, aims to detect, evaluate, and minimize harmful effects related to medication use. The data collection for pharmacovigilance depends on spontaneous reporting systems, where healthcare professionals or patients voluntarily report suspected ADRs.
In some cases, there...
This process, termed pharmacovigilance, aims to detect, evaluate, and minimize harmful effects related to medication use. The data collection for pharmacovigilance depends on spontaneous reporting systems, where healthcare professionals or patients voluntarily report suspected ADRs.
In some cases, there...
788
Model Approaches for Pharmacokinetic Data: Distributed Parameter Models
64
Pharmacokinetic models are mathematical constructs that represent and predict the time course of drug concentrations in the body, providing meaningful pharmacokinetic parameters. These models are categorized into compartment, physiological, and distributed parameter models.
The distributed parameter models are specifically designed to account for variations and differences in some drug classes. This model is particularly useful for assessing regional concentrations of anticancer or...
The distributed parameter models are specifically designed to account for variations and differences in some drug classes. This model is particularly useful for assessing regional concentrations of anticancer or...
64
Analysis Methods of Pharmacokinetic Data: Model and Model-Independent Approaches
103
Drug disposition in the body is a complex process and can be studied using two major approaches: the model and the model-independent approaches.
The model approach uses mathematical models to describe changes in drug concentration over time. Pharmacokinetic models help characterize drug behavior in patients, predict drug concentration in the body fluids, calculate optimum dosage regimens, and evaluate the risk of toxicity. However, ensuring that the model fits the experimental data accurately...
The model approach uses mathematical models to describe changes in drug concentration over time. Pharmacokinetic models help characterize drug behavior in patients, predict drug concentration in the body fluids, calculate optimum dosage regimens, and evaluate the risk of toxicity. However, ensuring that the model fits the experimental data accurately...
103
Pharmacokinetic Models: Comparison and Selection Criterion
50
Physiological and compartmental models are valuable tools used in studying biological systems. These models rely on differential equations to maintain mass balance within the system, ensuring an accurate representation of the dynamic processes at play.
Physiological models take a detailed approach by considering specific molecular processes. They can predict drug distribution, metabolism, and elimination changes, providing a comprehensive understanding of how drugs interact with the body.
Physiological models take a detailed approach by considering specific molecular processes. They can predict drug distribution, metabolism, and elimination changes, providing a comprehensive understanding of how drugs interact with the body.
50
Analysis of Population Pharmacokinetic Data
240
Analysis of population pharmacokinetic data involves studying the behavior of drugs within diverse populations to understand their pharmacokinetic parameters. Traditional pharmacokinetic methods typically involve collecting samples from a few individuals and estimating these parameters. While these methods are commonly used, they have limitations in capturing the variability in drug response among individuals or heterogeneous populations. Population pharmacokinetics is employed to address these...
240
Pharmacokinetic Models: Overview
618
Pharmacokinetic models utilize mathematical analysis to achieve a detailed quantitative understanding of a drug's life cycle within the body. They are instrumental in simulating a drug's pharmacokinetic parameters, predicting drug concentrations over time, optimizing dosage regimens, linking concentrations with pharmacologic activity, and estimating potential toxicity.
There are three primary types of models: empirical, compartment, and physiological. Empirical models, with minimal...
There are three primary types of models: empirical, compartment, and physiological. Empirical models, with minimal...
618


