Embarking on a Chemical Space Odyssey.
Embarking on a Chemical Space Odyssey.
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DOI：
10.1021/acs.jmedchem.7b00423
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发表时间：
2017-03
影响因子：
7.3
通讯作者：
Shiao Y Chow;A. Nelson
中科院分区：
文献类型：
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作者：
Shiao Y Chow;A. Nelson
药物发现项目中探索的化学空间受到狭窄反应工具包的限制，甚至这些与极性和功能化底物的反应也经常失败。最近，高通量反应优化已集成到发现工作流程中，从而增加了工具包中特定反应类别的价值。高通量实验很可能会扩展在发现中广泛利用的合成化学，从而增加药物化学的创新。
The chemical space explored in drug discovery programs is restricted by a narrow reaction toolkit and the frequent failure of even these reactions with polar and functionalized substrates. Recently, high-throughput reaction optimization has been integrated into discovery workflows, thereby increasing the value of specific reaction classes in the toolkit. It is likely that high-throughput experimentation will enable expansion of the synthetic chemistry that is widely exploited in discovery, thereby increasing innovation in medicinal chemistry.