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. 2022 Mar 31;7(14):12138–12146. doi: 10.1021/acsomega.2c00424

Table 1. General Summary of All the Datasets Used in the Study.

  proteins compounds interactions
KIBAa (IC50) 961 30,474 61,624
Davis Metzb 237 18 4255
Davis Anastasiadisb 154 24 2575
a

Note: Proteins for drugs listed in the KIBA dataset were extracted manually from CHEMBL.

b

Used as an external validation dataset.