Dear INPST colleagues, we are currently looking for a collaboration within our project, aimed through molecular docking (MD) to study and track the possible interactions of certain natural products including celastrol, pristimererin, tingenone, iguesterin and quercetin-3-b-galactoside with 3CLpro of SARS-CoV2 as well as possible interactions of tanshinone I and hirsutenone with PLpro of SARS-CoV2.
Compounds showed potential inhibitory activity, via MD, against PLpro of SARS-CoV2, were Glycyrrhizin, Saikosaponin B2, Saikosaponin_A, Amentoflavone, Solasodine, Tingenone, Kolaviron, Pseudo-Ginsenoside F11, Iguesterin, Celastrol, Solanine.
Therefore, we are in particular interest to find a collaboration for providing these later 11 compounds to be tested using the PLpro of SARS-CoV2 assay kit, that we already purchased (for compounds with molecular weight less than 500, about 5-10 mg should be enough. For compounds with higher molecular weight, we need about double that amount).
We are a group of pharmacists, with different specialties working together on this project. We are happy to provide any details if you are interested.
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Dr. Nadia Hamdy
Prof. of Biochemistry, Project PI, Dept. Head,
Department of Biochemistry and Molecular Biology
Ain Shams University
Faculty of Pharmacy
Cairo, Egypt
COLLABORATION CALL: REPURPOSING OF SOME BIOACTIVE NATURAL PRODUCTS TO CONTROL COVID-19 INFECTION: A MOLECULAR DOCKING STUDY https://t.co/WkPvSf0Ouk #INPST #BIOACTIVE #NATURALPRODUCTS #COVID19 #INFECTION #MOLECULARDOCKING #globalhealth #OpenScience #scicomm #WomenInSTEM #STEM pic.twitter.com/s9vxNzBul4
— International Natural Product Sciences Taskforce (@_INPST) July 25, 2021