Table 1.

In silico binding of antibiotic compounds reversing PCS1, 42DENZR, and 42FENZR signatures to FOXM1 DNA–binding domain analyzed using SwissDock

DrugTargetFOXM1, estimated ΔG (kcal/mol)FOXM1, FullFitness (kcal/mol)
MonensinAntibiotic–12.94–1556.22
IdarubicinAntibiotic, topoisomerase II inhibitor–7.96–807.24
BithionolAntibacterial and anthelmintic–6.49–788.62
ManumycinAntibiotic, Ras inhibitor–6.46–601.04
CCCPAntibiotic, inhibitor of oxidative phosphorylation–6.16–776.52
ThiostreptonFOXM1 inhibitor–9.4 kcal/mol (31)
OligomycinAntibiotic, mitochondrial ATP synthase inhibitor3D structure not available in the ZINC database
SelamectinAnthelmintic3D structure not available in the ZINC database