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. Author manuscript; available in PMC: 2019 Nov 4.
Published in final edited form as: Biochem Pharmacol. 2017 Jan 25;130:93–103. doi: 10.1016/j.bcp.2017.01.010

Fig. 1. Pharmacophore model used for virtual screening of the DrugBank database.

Fig. 1

(A) The model consists of four hydrophobic (H) features (cyan), two hydrogen bond acceptors (HBA, green) and a sterical shape restriction (grey) [39]. (B) Virtual hits from the DrugBank screening fitted into the model. Compounds are color-coded: red – tioconazole; green – butoconazole; violet – sertaconazole.