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. Author manuscript; available in PMC: 2024 Sep 14.
Published in final edited form as: J Med Chem. 2023 Aug 23;66(17):12459–12467. doi: 10.1021/acs.jmedchem.3c00974

Figure 6. Dispirotripiperazine (DSTP) series used as an external test set for machine learning models for HBV inhibition.

Figure 6.

(A) Truth tables, statistical analysis (classification) and correlational visualization (regression) for the tested DSTPs. (B) A t-SNE visualization showing the ChEMBL HBV inhibition training set, FDA approved drugs and the tested DSTPs.