| target | name | atc | score_pharm3D | score_tanimoto | best | rank | category | classification |
|---|---|---|---|---|---|---|---|---|
| DB09050 | Ceftolozane | J01DI54 | -76.472 | -72.721 | -76.472 | 1.0 | Antiinfectives | Approved |
| DB00619 | Imatinib | L01XE01 | -53.026 | -68.018 | -68.018 | 2.0 | Other | Approved |
| DB00460 | Verteporfin | S01LA01 | -66.905 | -54.423 | -66.905 | 3.0 | Other | Approved |
| DB05521 | Telaprevir | J05AP02 | -56.025 | -64.398 | -64.398 | 4.0 | Protease-Inhibitors | Approved |
| DB01259 | Lapatinib | L01XE07 | -64.314 | -57.024 | -64.314 | 5.0 | Other | Approved |
| DB13947 | Testosterone-enantate-benzilic-acid-hydrazone | NA | -63.336 | -56.418 | -63.336 | 6.0 | NA | Approved |
| DB00303 | Ertapenem | J01DH03 | -47.774 | -62.967 | -62.967 | 7.0 | Antiinfectives | Approved |
| DB06290 | Simeprevir | G01AE10,J05AP05 | -62.839 | -45.632 | -62.839 | 8.0 | Protease-Inhibitors | Approved |
| DB11979 | Elagolix | NA | -61.135 | -51.301 | -61.135 | 9.0 | NA | Approved |
| DB01319 | Fosamprenavir | J05AE07 | -60.014 | -45.474 | -60.014 | 10.0 | Protease-Inhibitors | Approved |
| target | name | atc | score_pharm3D | score_tanimoto | best | rank | category | classification |
|---|---|---|---|---|---|---|---|---|
| DB09050 | Ceftolozane | J01DI54 | -77.715 | -74.069 | -77.715 | 1.0 | Antiinfectives | Approved |
| DB00619 | Imatinib | L01XE01 | -53.026 | -68.018 | -68.018 | 2.0 | Other | Approved |
| DB00460 | Verteporfin | S01LA01 | -66.905 | -54.423 | -66.905 | 3.0 | Other | Approved |
| DB01167 | Itraconazole | J02AC02 | -65.107 | -38.247 | -65.107 | 4.0 | Antiinfectives | Approved |
| DB01263 | Posaconazole | J02AC04 | -45.157 | -64.432 | -64.432 | 5.0 | Antiinfectives | Approved |
| DB05521 | Telaprevir | J05AP02 | -56.025 | -64.398 | -64.398 | 6.0 | Protease-Inhibitors | Approved |
| DB01259 | Lapatinib | L01XE07 | -64.314 | -57.024 | -64.314 | 7.0 | Other | Approved |
| DB06809 | Plerixafor | L03AX16 | -53.524 | -64.146 | -64.146 | 8.0 | Other | Approved |
| DB00966 | Telmisartan | C09DB04,C09CA07,C09DA07 | -50.497 | -63.459 | -63.459 | 9.0 | Other | Approved |
| DB11262 | Bisoctrizole | NA | -54.052 | -63.362 | -63.362 | 10.0 | NA | Approved |