Search for: [Abstract = "the ZINC15 database for new BGT\-1 transporter inhibitors was also carried out as a part of this thesis. The screening was based on the physicochemical properties of the compounds, a simplified pharmacophore model and molecular docking to the BGT\-1 homology models. Finally, 12 compounds were selected, purchased and subsequently tested in vitro in the \[3H\]GABA uptake assay. The most active compound KL\-202 shows moderate potency on the BGT\-1 \(IC50 = 48.9 μM\) and GAT\-3 \(IC50 = 46.8 μM\) transporters. The low molecular weight and high synthetic availability of compound KL\-202 provide the potential for further development to obtain derivatives with higher activity and selectivity. The research carried out in this doctoral dissertation significantly broadened the knowledge of the structure of GABA and glycine transporters. This can support the rational design of their new inhibitors with desirable properties."]

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