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1. 发明申请

US20060110743A1 Drug evolution: drug design at hot spots 审中-公开
标题翻译：药物进化：药物设计在热点
公开(公告)号：US20060110743A1
公开(公告)日：2006-05-25
申请号：US10992997
申请日：2004-11-19
申请人： Yasuo Konishi , Sung Cho , Alicja Kluczyk , Carmen Lazar , Taira Kiyota
发明人： Yasuo Konishi , Sung Cho , Alicja Kluczyk , Carmen Lazar , Taira Kiyota
IPC分类号： C40B40/08 , C40B40/10 , C40B30/02
CPC分类号： C40B30/00 , C07C229/60 , C07C229/62 , C07C233/81 , C07C235/52 , C07C237/22 , C07C237/30 , C07C237/34 , C07C237/36 , C07C237/44 , C07C311/13 , C07D295/13 , C07D295/15 , C07H15/203 , C40B40/04 , G01N21/33
摘要： A new method of designing and generating compounds having an increased probability of being drugs, drug candidates, or biologically active compounds, in particular having a therapeutic utility, is disclosed. The method consists of identifying a group of bioactive compounds, preferably of diverse therapeutic uses or biological activities and built on a common building block. In this group of compounds, side chains modifying the building block are identified and used to generate a second set of compounds according to the proposed methods of hybridization”, “single substitution” or “incorporation of frequently used side chains”. If the compounds in the second set built on the same building block contain an unusually large number of drugs, preferably with diverse therapeutic uses or biological activities, they constitute a “hot spot”. A focused combinatorial library of the “hot spot” is then generated, preferably by methods of combinatorial chemistry, and compounds of this library are screened for a variety of therapeutic uses or biological activities. The method generates drugs, drug candidates, or biologically active compounds with a high probability, without requiring any prior knowledge of biological targets.
摘要翻译：公开了一种设计和产生药物，候选药物或生物活性化合物的可能性增加的化合物的新方法，特别是具有治疗效用。该方法包括鉴定一组生物活性化合物，优选不同的治疗用途或生物活性，并建立在共同的结构单元上。在这组化合物中，鉴定修饰结构单元的侧链，并用于根据所提出的杂交方法“，”单取代“或”引入常用的侧链“产生第二组化合物。建立在同一建筑物上的第二套装置含有非常多的药物，优选具有多种治疗用途或生物活性，它们构成“热点”，然后产生“热点”的聚焦组合文库，优选通过组合化学方法和该文库的化合物被筛选用于各种治疗用途或生物活性，该方法以高概率产生药物，候选药物或生物活性化合物，而不需要任何生物靶标的任何知识。

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