Discovery of Potential Orthosteric and Allosteric Antagonists of P2Y1R from Chinese Herbs by Molecular Simulation Methods

<div>Structure, ID number, and biological values (IC50) of active compounds in the orthosteric test set.</div>

Evidence-Based Complementary and Alternative Medicine

Figure 3: Discovery of Potential Orthosteric and Allosteric Antagonists of P2Y1R from Chinese Herbs by Molecular Simulation Methods 