Abstract:
:Traditional fragment-based drug discovery (FBDD) relies heavily on structural analysis of the hits bound to their targets. Herein, we present a complementary approach based on diversity-oriented synthesis (DOS). A DOS-based fragment collection was able to produce initial hit compounds against the target GSK3β, allow the systematic synthesis of related fragment analogues to explore fragment-level structure-activity relationship, and finally lead to the synthesis of a more potent compound.
journal_name
ACS Med Chem Lettjournal_title
ACS medicinal chemistry lettersauthors
Wang Y,Wach JY,Sheehan P,Zhong C,Zhan C,Harris R,Almo SC,Bishop J,Haggarty SJ,Ramek A,Berry KN,O'Herin C,Koehler AN,Hung AW,Young DWdoi
10.1021/acsmedchemlett.6b00230subject
Has Abstractpub_date
2016-07-14 00:00:00pages
852-6issue
9issn
1948-5875journal_volume
7pub_type
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