Extended Data Fig. 8: Drug development of 5-HT5AR.
From: Inactive and active state structures template selective tools for the human 5-HT5A receptor

a-b, Chemical structures of all the designed compounds in the second (a) and third rounds (b) of structure-based drug development of 5-HT5AR. Compounds with the ID colored in black or pink are selected from the patent or newly designed, respectively. The starting compound in each cycle is highlighted in a yellow shaded box. The varied moieties are colored in the corresponding color used in the starting compound. The predicted ΔΔG values by the FEP method are also labeled under the corresponding compound.