2022
DOI: 10.1039/d2sc02474h
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Navigating chemical reaction space – application to DNA-encoded chemistry

Abstract: Databases contain millions of reactions for compound synthesis, rendering selection of reactions for forward synthetic design of small molecule screening libraries, such as DNA-encoded libraries (DELs), a big data challenge....

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Cited by 3 publications
(2 citation statements)
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“…Altogether, a photochemical DEL reaction was performed in the photoreactor developed by rapid prototyping and adapted to the flow reactor setup. These promising results pave the way to a wider application and scalability for continuous flow systems and fast access to a new chemical reaction space in DELT ( González-Esguevillas et al, 2021 ; Chines et al, 2022 ). The photoredox reactions exhibit enormous potential for synthesizing DEL.…”
Section: Discussionmentioning
confidence: 94%
“…Altogether, a photochemical DEL reaction was performed in the photoreactor developed by rapid prototyping and adapted to the flow reactor setup. These promising results pave the way to a wider application and scalability for continuous flow systems and fast access to a new chemical reaction space in DELT ( González-Esguevillas et al, 2021 ; Chines et al, 2022 ). The photoredox reactions exhibit enormous potential for synthesizing DEL.…”
Section: Discussionmentioning
confidence: 94%
“…After tagged barcode amplification and sequencing, the optimal binder can be thus identified in the selection of DELs. [20][21][22][23][24][25] Generally, the encoded libraries are constructed via iterative steps of combinatory synthesis and enzymatic encoding ligation. [26][27][28][29][30] Numerous reaction toolkits, which must be DNA-compatible, have been thereby developed and employed to construct encoded libraries, and the building blocks (BBs) for library construction should be conveniently accessible or commercially available to expand the chemical diversities to more complicated molecular architectures beyond encoding early-stage peptide-like libraries.…”
mentioning
confidence: 99%