Logistic Classification Models for PH–Permeability Profile: Predicting Permeability Classes for the Biopharmaceutical Classification System

M Oja, S Sild, U Maran - Journal of Chemical Information and …, 2019 - ACS Publications
Permeability is used to describe and evaluate the absorption of drug substances in the
human gastrointestinal tract (GIT). Permeability is largely dependent on fluctuating pH that …

Integrating theoretical and experimental permeability estimations for provisional biopharmaceutical classification: Application to the WHO essential medicines

MÁ Cabrera‐Pérez, H Pham‐The… - … & Drug Disposition, 2018 - Wiley Online Library
The accuracy of the provisional estimation of the Biopharmaceutics Classification System
(BCS) is heavily influenced by the permeability measurement. In this study, several …

Application of data mining approach to identify drug subclasses based on solubility and permeability

B Gatarić, J Parojčić - Biopharmaceutics & Drug Disposition, 2019 - Wiley Online Library
Solubility and permeability are recognized as key parameters governing drug intestinal
absorption and represent the basis for biopharmaceutics drug classification. The …

[HTML][HTML] Trivariate linear regression and machine learning prediction of possible roles of efflux transporters in estimated intestinal permeability values of 301 disparate …

M Shimizu, R Hayasaka, Y Kamiya… - Biological and …, 2022 - jstage.jst.go.jp
A system for predicting apparent bidirectional permeability (P app) across Caco-2 cells of
diverse chemicals has been reported. The present study aimed to investigate the …

Hydrogen bonding descriptors in the prediction of human in vivo intestinal permeability

S Winiwarter, F Ax, H Lennernäs, A Hallberg… - Journal of Molecular …, 2003 - Elsevier
Hydrogen bonding has been identified as an important parameter for describing drug
permeability. Recently, we derived models for predicting intestinal permeability using the …

pH-permeability profiles for drug substances: Experimental detection, comparison with human intestinal absorption and modelling

M Oja, U Maran - European Journal of Pharmaceutical Sciences, 2018 - Elsevier
The influence of pH on human intestinal absorption is frequently not considered in early
drug discovery studies in the modelling and subsequent prediction of intestinal absorption …

Permeability diagnosis model in drug discovery: a diagnostic tool to identify the most influencing properties for gastrointestinal permeability

J Wang, S Skolnik - Current Topics in Medicinal Chemistry, 2013 - ingentaconnect.com
Permeability is important in governing the ability of drug substances to transport across
gastrointestinal membrane and also crucial for proper drug distribution to pharmacological …

Provisional Classification and in Silico Study of Biopharmaceutical System Based on Caco-2 Cell Permeability and Dose Number

H Pham-The, T Garrigues, M Bermejo… - Molecular …, 2013 - ACS Publications
Today, early characterization of drug properties by the Biopharmaceutics Classification
System (BCS) has attracted significant attention in pharmaceutical discovery and …

pH-Dependent solubility and permeability criteria for provisional biopharmaceutics classification (BCS and BDDCS) in early drug discovery

MV Varma, I Gardner, SJ Steyn, P Nkansah… - Molecular …, 2012 - ACS Publications
The Biopharmaceutics Classification System (BCS) is a scientific framework that provides a
basis for predicting the oral absorption of drugs. These concepts have been extended in the …

Highly predictive and interpretable models for PAMPA permeability

H Sun, K Nguyen, E Kerns, Z Yan, KR Yu… - Bioorganic & medicinal …, 2017 - Elsevier
Cell membrane permeability is an important determinant for oral absorption and
bioavailability of a drug molecule. An in silico model predicting drug permeability is …