Prediction of drug’s anatomical therapeutic chemical (ATC) code by constructing biological profiles of ATC codes

BMC Bioinformatics

Table 10 Performance of PDATC-NCPMKL-updated on different drug-ATC code association groups

Object	Drug group	ATC code group	Second level		Third level		Fourth level
Object	Drug group	ATC code group	AUROC	AUPR	AUROC	AUPR	AUROC	AUPR
Target protein	High	High	0.9629	0.9669	0.9729	0.9743	0.9718	0.9724
	High	Low	0.9631	0.9665	0.9627	0.9657	0.9725	0.9717
	Low	High	0.9636	0.9688	0.9655	0.9692	0.9694	0.9708
	Low	Low	0.9611	0.9665	0.9631	0.9659	0.9733	0.9732
Fingerprint	High	High	0.9633	0.9674	0.9663	0.9685	0.9722	0.9739
	High	Low	0.9670	0.9706	0.9636	0.9680	0.9704	0.9701
	Low	High	0.9574	0.9623	0.9709	0.9723	0.9736	0.9744
	Low	Low	0.9605	0.9660	0.9590	0.9646	0.9699	0.9710
Side effect	High	High	0.9624	0.9677	0.9693	0.9710	0.9744	0.9741
	High	Low	0.9513	0.9534	0.9797	0.9821	0.9759	0.9750
	Low	High	0.9629	0.9668	0.9664	0.9676	0.9679	0.9682
	Low	Low	0.9577	0.9627	0.9689	0.9725	0.9625	0.9638

ISSN: 1471-2105