Abstract
From a perspective of process knowledge and enhancement, the analysis of the results of biological screening should not be limited to the outcome of specific projects, but additionally encompass a process centric view. Summarising outcomes across multiple projects is a powerful tool to gain a greater understanding of biological screening that will also enable optimisation of the strategy for specific projects or target classes. We have analysed a set of 73651 compounds with reproducible (confirmed) results from 63 high-throughput screening (HTS) campaigns to reveal the underlying trends in the population of active compounds. We have focused on the overall physico-chemical profile of compound populations derived from biological screening since the in vivo activity of drug molecules is the result of physicochemical and structural properties of the compound.
Keywords: high-throughput screening (HTS), Oxaprozin, compound aggregation, SEQUENCE ANALYSIS, drug discovery
Combinatorial Chemistry & High Throughput Screening
Title: Analysing the Output from Primary Screening
Volume: 9 Issue: 5
Author(s): Dawn Nowlin, Patrick Bingham, Andrew Berridge, Philip Gribbon, Philip Laflin and Andreas Sewing
Affiliation:
Keywords: high-throughput screening (HTS), Oxaprozin, compound aggregation, SEQUENCE ANALYSIS, drug discovery
Abstract: From a perspective of process knowledge and enhancement, the analysis of the results of biological screening should not be limited to the outcome of specific projects, but additionally encompass a process centric view. Summarising outcomes across multiple projects is a powerful tool to gain a greater understanding of biological screening that will also enable optimisation of the strategy for specific projects or target classes. We have analysed a set of 73651 compounds with reproducible (confirmed) results from 63 high-throughput screening (HTS) campaigns to reveal the underlying trends in the population of active compounds. We have focused on the overall physico-chemical profile of compound populations derived from biological screening since the in vivo activity of drug molecules is the result of physicochemical and structural properties of the compound.
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Cite this article as:
Nowlin Dawn, Bingham Patrick, Berridge Andrew, Gribbon Philip, Laflin Philip and Sewing Andreas, Analysing the Output from Primary Screening, Combinatorial Chemistry & High Throughput Screening 2006; 9 (5) . https://dx.doi.org/10.2174/138620706777452401
DOI https://dx.doi.org/10.2174/138620706777452401 |
Print ISSN 1386-2073 |
Publisher Name Bentham Science Publisher |
Online ISSN 1875-5402 |
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