Minerva

Set of rules for identifying multi-target ligand for Alzheimer's disease

Datasets taken from the latest release of ChEMBL database
33 indipendent machine learning models built on each available target
Core-Substituent Fingerprint

More information at:

https://doi.org/10.3390/molecules27072331

SHAP values for models explanation and interpretability

Download SHAP summary plots per threshold:

10 nM
100 nM
10 µM
1 µM