Open Source Drug Discovery: Highly Potent Antimalarial Compounds Derived from the Tres Cantos Arylpyrroles
Author(s)
Type
Journal Article
Abstract
The development of new antimalarial compounds remains a pivotal part of the strategy for malaria elimination. Recent large-scale phenotypic screens have provided a wealth of potential starting points for hit-to-lead campaigns. One such public set is explored, employing an open source research mechanism in which all data and ideas were shared in real time, anyone was able to participate, and patents were not sought. One chemical subseries was found to exhibit oral activity but contained a labile ester that could not be replaced without loss of activity, and the original hit exhibited remarkable sensitivity to minor structural change. A second subseries displayed high potency, including activity within gametocyte and liver stage assays, but at the cost of low solubility. As an open source research project, unexplored avenues are clearly identified and may be explored further by the community; new findings may be cumulatively added to the present work.
Date Issued
2016-09-14
Date Acceptance
2016-09-01
Citation
ACS Central Science, 2016, 2 (10), pp.687-701
ISSN
2374-7943
Publisher
American Chemical Society
Start Page
687
End Page
701
Journal / Book Title
ACS Central Science
Volume
2
Issue
10
Copyright Statement
This is an open access article published under a Creative Commons Attribution (CC-BY) License, which permits unrestricted use, distribution and reproduction in any medium, provided the author and source are cited.
License URL
Subjects
Science & Technology
Physical Sciences
Chemistry, Multidisciplinary
Chemistry
OPEN-SOURCE SOFTWARE
PLASMODIUM-FALCIPARUM
SPIROINDOLONE ANTIMALARIALS
CYCLOPROPYL CARBOXAMIDES
MEDICINAL CHEMISTRY
TROPICAL DISEASES
MALARIA PARASITE
STARTING POINTS
OPEN INNOVATION
TARGET
Publication Status
Published