GPCR-Targeted Library
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چکیده
Introduction Owing to historic inefficiency of mass random bioscreening, the current paradigm suggests that target-specific and pharmacokinetic properties of small molecule libraries should be addressed as early as possible in the discovery process. Computational medicinal chemistry can address this problem at the level of pre-synthetic library design. A number of advanced in silico methods have recently been developed and applied to combinatorial templates to enhance their target-specific informational content. Appropriate strategies for the design of combinatorial libraries are developed in accordance with the target, disease area, resources on hand and the specific project goals. In this description, we present a rational, practical approach to the design of GPCR-targeted combinatorial library. The goal of the combinatorial synthesis planning strategy presented here is to construct an algorithm utilizing simple, automated procedures for designing combinatorial libraries that are expected to show GPCR-activity.
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GPCR-Targeted Library
Owing to historic inefficiency of mass random bioscreening, the current paradigm suggests that target-specific and pharmacokinetic properties of small molecule libraries should be addressed as early as possible in the discovery process. Computational medicinal chemistry can address this problem at the level of pre-synthetic library design. A number of advanced in silico methods have recently be...
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