Table 1 Statistics of BindingDB datasets.

From: Predicting drug-target interactions using machine learning with improved data balancing and feature engineering

Dataset

DTI Pairs

Unique drugs

Unique proteins

BindingDB_Kd

52,284

10,665

1,413

BindingDB_Ki

375,032

174,662

3,070

BindingDB_IC50

991,486

549,205

5,078

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