Literature DB >> 11911711

The "latent membrane permeability" concept: QSPR analysis of inter/intralaboratory variable Caco-2 permeability.

Fumiyoshi Yamashita1, Shin-ichi Fujiwara, Mitsuru Hashida.   

Abstract

Caco-2 cell monolayers grown on a filter support are the most widely used systems for predicting intestinal absorption. However, inter- and intralaboratory variability in Caco-2 permeability makes it difficult to analyze any QSPR relationship for a large number of compounds. We proposed the "latent membrane permeability" concept, assuming that all Caco-2 permeability data sets share a hidden, common relationship between their membrane permeability and physicochemical properties. An iterative calculation method was developed to handle this conceptual approach and applied to the analysis of Caco-2 permeability data sets from different sources. A thorough statistical analysis revealed that the "latent membrane permeability" concept be reasonable.

Mesh:

Year:  2002        PMID: 11911711     DOI: 10.1021/ci010317y

Source DB:  PubMed          Journal:  J Chem Inf Comput Sci        ISSN: 0095-2338


  2 in total

Review 1.  Recent progress in the computational prediction of aqueous solubility and absorption.

Authors:  Stephen R Johnson; Weifan Zheng
Journal:  AAPS J       Date:  2006-02-03       Impact factor: 4.009

2.  Development of a Hierarchical Support Vector Regression-Based In Silico Model for Caco-2 Permeability.

Authors:  Giang Huong Ta; Cin-Syong Jhang; Ching-Feng Weng; Max K Leong
Journal:  Pharmaceutics       Date:  2021-01-28       Impact factor: 6.321

  2 in total

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