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Table 6 MDDR classes that contain higher percentage (≥3%) of SVM virtual-hits and the percentage values

From: Development and experimental test of support vector machines virtual screening method for searching Src inhibitors from large compound libraries

MDDR Classes that contain higher percentage (≥3%) of virtual hits

No of virtual hits in class

Percentage of class members selected as virtual hits

Antineoplastic

623

2.9%

Tyrosine-Specific Protein Kinase Inhibitor

231

19.6%

Signal Transduction Inhibitor

194

9.5%

Antiarthritic

176

1.5%

Antiallergic/Antiasthmatic

83

0.8%

Antihypertensive

76

0.7%

Antiangiogenic

75

4.6%

Treatment for Osteoporosis

55

2.2%

Antidepressant

49

0.8%

  1. Virtual-hits are identified by SVMs in screening 168K MDDR compounds for Src inhibitors. The total number of SVM identified virtual hits is 1,496.