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The Mathematics of a Successful Deconvolution: A Quantitative Assessment of Mixture-Based Combinatorial Libraries Screened Against Two Formylpeptide Receptors

In the past 20 years, synthetic combinatorial methods have fundamentally advanced the ability to synthesize and screen large numbers of compounds for drug discovery and basic research. Mixture-based libraries and positional scanning deconvolution combine two approaches for the rapid identification o...

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Detalles Bibliográficos
Autores principales: Santos, Radleigh G., Appel, Jon R., Giulianotti, Marc A., Edwards, Bruce S., Sklar, Larry A., Houghten, Richard A., Pinilla, Clemencia
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2013
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4106117/
https://www.ncbi.nlm.nih.gov/pubmed/23722730
http://dx.doi.org/10.3390/molecules18066408
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author Santos, Radleigh G.
Appel, Jon R.
Giulianotti, Marc A.
Edwards, Bruce S.
Sklar, Larry A.
Houghten, Richard A.
Pinilla, Clemencia
author_facet Santos, Radleigh G.
Appel, Jon R.
Giulianotti, Marc A.
Edwards, Bruce S.
Sklar, Larry A.
Houghten, Richard A.
Pinilla, Clemencia
author_sort Santos, Radleigh G.
collection PubMed
description In the past 20 years, synthetic combinatorial methods have fundamentally advanced the ability to synthesize and screen large numbers of compounds for drug discovery and basic research. Mixture-based libraries and positional scanning deconvolution combine two approaches for the rapid identification of specific scaffolds and active ligands. Here we present a quantitative assessment of the screening of 32 positional scanning libraries in the identification of highly specific and selective ligands for two formylpeptide receptors. We also compare and contrast two mixture-based library approaches using a mathematical model to facilitate the selection of active scaffolds and libraries to be pursued for further evaluation. The flexibility demonstrated in the differently formatted mixture-based libraries allows for their screening in a wide range of assays.
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spelling pubmed-41061172014-07-22 The Mathematics of a Successful Deconvolution: A Quantitative Assessment of Mixture-Based Combinatorial Libraries Screened Against Two Formylpeptide Receptors Santos, Radleigh G. Appel, Jon R. Giulianotti, Marc A. Edwards, Bruce S. Sklar, Larry A. Houghten, Richard A. Pinilla, Clemencia Molecules Article In the past 20 years, synthetic combinatorial methods have fundamentally advanced the ability to synthesize and screen large numbers of compounds for drug discovery and basic research. Mixture-based libraries and positional scanning deconvolution combine two approaches for the rapid identification of specific scaffolds and active ligands. Here we present a quantitative assessment of the screening of 32 positional scanning libraries in the identification of highly specific and selective ligands for two formylpeptide receptors. We also compare and contrast two mixture-based library approaches using a mathematical model to facilitate the selection of active scaffolds and libraries to be pursued for further evaluation. The flexibility demonstrated in the differently formatted mixture-based libraries allows for their screening in a wide range of assays. MDPI 2013-05-30 /pmc/articles/PMC4106117/ /pubmed/23722730 http://dx.doi.org/10.3390/molecules18066408 Text en © 2013 by the authors; licensee MDPI, Basel, Switzerland. http://creativecommons.org/licenses/by/3.0/ This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution license (http://creativecommons.org/licenses/by/3.0/).
spellingShingle Article
Santos, Radleigh G.
Appel, Jon R.
Giulianotti, Marc A.
Edwards, Bruce S.
Sklar, Larry A.
Houghten, Richard A.
Pinilla, Clemencia
The Mathematics of a Successful Deconvolution: A Quantitative Assessment of Mixture-Based Combinatorial Libraries Screened Against Two Formylpeptide Receptors
title The Mathematics of a Successful Deconvolution: A Quantitative Assessment of Mixture-Based Combinatorial Libraries Screened Against Two Formylpeptide Receptors
title_full The Mathematics of a Successful Deconvolution: A Quantitative Assessment of Mixture-Based Combinatorial Libraries Screened Against Two Formylpeptide Receptors
title_fullStr The Mathematics of a Successful Deconvolution: A Quantitative Assessment of Mixture-Based Combinatorial Libraries Screened Against Two Formylpeptide Receptors
title_full_unstemmed The Mathematics of a Successful Deconvolution: A Quantitative Assessment of Mixture-Based Combinatorial Libraries Screened Against Two Formylpeptide Receptors
title_short The Mathematics of a Successful Deconvolution: A Quantitative Assessment of Mixture-Based Combinatorial Libraries Screened Against Two Formylpeptide Receptors
title_sort mathematics of a successful deconvolution: a quantitative assessment of mixture-based combinatorial libraries screened against two formylpeptide receptors
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4106117/
https://www.ncbi.nlm.nih.gov/pubmed/23722730
http://dx.doi.org/10.3390/molecules18066408
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