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Issue 4, 2015
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Relating Caco-2 permeability to molecular properties using block relevance analysis

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Abstract

Here we describe a new approach for facilitating a mechanistic understanding of high throughput Caco-2 permeability data. A large, uniform set of permeability data is reported, generated under two pH conditions. It was found that these data could be successfully modelled, and that a mechanistic understanding of apparent permeability could be gained.

Graphical abstract: Relating Caco-2 permeability to molecular properties using block relevance analysis

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Supplementary files

Article information


Submitted
16 Oct 2014
Accepted
05 Dec 2014
First published
08 Dec 2014

Med. Chem. Commun., 2015,6, 626-629
Article type
Concise Article
Author version available

Relating Caco-2 permeability to molecular properties using block relevance analysis

T. Potter, G. Ermondi, G. Newbury and G. Caron, Med. Chem. Commun., 2015, 6, 626
DOI: 10.1039/C4MD00470A

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