Events 1st International Electronic Conference on Biomedicine

Event submissions

Published

10.3390/ECB2021-10258

This submission belongs to the session S10. G-protein-coupled Receptor Family of the event 1st International Electronic Conference on Biomedicine

Published date

31 May, 2021

Citation

Sabina Podlewska, Agnieszka Pocha, Rafał Jankowski, Optimization of metabolic stability of ligands of serotonin receptor 5-HT7 using SHAP values, in Proceedings of 1st International Electronic Conference on Biomedicine, 1 June–26 June 2021, MDPI: Basel, Switzerland, doi: 10.3390/ECB2021-10258

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Optimization of metabolic stability of ligands of serotonin receptor 5-HT7 using SHAP values

Agnieszka Pocha ¹

Rafał Jankowski ¹

Sabina Podlewska ²

1. Faculty of Mathematics and Computer Science, Jagiellonian University, 6 S. Lojasiewicza Street, 30‑348 Krakow, Poland

2. Maj Institute of Pharmacology Polish Academy of Sciences, Smetna Street 12, 31-343 Krakow

Abstract

Keywords

serotonin receptor 5-HT7

metabolic stability

SHAP values

G protein-coupled receptors

molecular modeling