Quantitative structure–activity relationships (QSARs) for the prediction of skin permeation of exogenous chemicals

Patel, Hiren; Berge, Wil ten; Cronin, Mark T.D.

doi:10.1016/s0045-6535(02)00114-5

Cited by 184 publications

(88 citation statements)

References 27 publications

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“…Various studies have investigated whether MW or MV is a more effective parameter to describe molecular size in the models (Barratt, 1995;Potts & Guy, 1995;Patel et al, 2002).…”

Section: Qspr Models Based On Molecular Size And/or Lipophilicity Parmentioning

confidence: 99%

Quantitative structure-skin permeability relationships

et al. 2017

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Quantitative Structure -Skin permeability Relationships http://researchonline.ljmu.ac.uk/6719/ Article LJMU has developed LJMU Research Online for users to access the research output of the University more effectively. Copyright © and Moral Rights for the papers on this site are retained by the individual authors and/or other copyright owners. Users may download and/or print one copy of any article(s) in LJMU Research Online to facilitate their private study or for non-commercial research. You may not engage in further distribution of the material or use it for any profit-making activities or any commercial gain.The version presented here may differ from the published version or from the version of the record. Please see the repository URL above for details on accessing the published version and note that access may require a subscription. This paper reviews in silico models currently available for the prediction of skin permeability with the main focus on the quantitative structure-permeability relationship (QSPR) models. A comprehensive analysis of the main achievements in the field in the last decade is provided. In addition, the mechanistic models are discussed and comparative studies that analyse different models are discussed. (to be extended to 100--200 words)

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“…Various studies have investigated whether MW or MV is a more effective parameter to describe molecular size in the models (Barratt, 1995;Potts & Guy, 1995;Patel et al, 2002).…”

Section: Qspr Models Based On Molecular Size And/or Lipophilicity Parmentioning

confidence: 99%

Quantitative structure-skin permeability relationships

et al. 2017

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“…However, more significant is the understanding of how the quality of data input to a model affects the nature of its output. This work was expanded upon using a larger data set [11] yielding a complex model of skin permeability that returned as ‘significant' complex parameters that are not readily calculable without specialist software: …”

Section: Mark Cronin Professor Of Predictive Toxicology School Of Pmentioning

confidence: 99%

The Contributions of the Celtic Masters and Their Associates

Gp¹

2013

Skin Pharmacol Physiol

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“…temperature and humidity. 62,63 As a result of epidermal barrier damage, inflammatory mediators are produced to stimulate repair of the skin barrier. Keratinocytes are the major contributors in this inflammatory response by production of cytokines and chemokines.…”

Section: Effects Of Irritants On Skinmentioning

confidence: 99%

Individual susceptibility to chronic irritant contact dermatitis

2008

TVBV

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Quantitative structure–activity relationships (QSARs) for the prediction of skin permeation of exogenous chemicals

Cited by 184 publications

References 27 publications

Quantitative structure-skin permeability relationships

Quantitative structure-skin permeability relationships

The Contributions of the Celtic Masters and Their Associates

Individual susceptibility to chronic irritant contact dermatitis

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