ChemRxiv
These are preliminary reports that have not been peer-reviewed. They should not be regarded as conclusive, guide clinical practice/health-related behavior, or be reported in news media as established information. For more information, please see our FAQs.
1/1
2 files

Co-crystals of Praziquantel: Discovery by Network-Based Link Prediction

preprint
revised on 19.02.2021, 07:38 and posted on 19.02.2021, 09:30 by Jan-Joris Devogelaer, Maxime D. Charpentier, Arnoud Tijink, Valérie Dupray, Gérard Coquerel, Karen Johnston, Hugo Meekes, Paul Tinnemans, Elias Vlieg, Joop H. ter Horst, Rene de Gelder
In this study, co-crystals for Praziquantel (PZQ), an anthelmintic drug used to treat schistosomiasis, are predicted with network-based link prediction. Single crystals of twelve co-crystal indications were grown and subjected to a structural analysis with single-crystal X-ray diffraction.

Funding

Continuous Resolution and Deracemization of Chiral Compounds by Crystallization

European Commission

Find out more...

History

Email Address of Submitting Author

j.devogelaer@science.ru.nl

Institution

Radboud University

Country

The Netherlands

ORCID For Submitting Author

0000-0001-9533-2590

Declaration of Conflict of Interest

No conflict of interest

Version Notes

Version 2 - Minor revisions to text and updated discussion part.