Table 1.
Compound–Compound Target Network Information
| Mol ID | Compound | MW | OB (%) | DL | Medicine | Database Source |
|---|---|---|---|---|---|---|
| MOL000359 | Sitosterol | 414.79 | 36.91 | 0.75 | SDH, SZY, MDP, ZX | TCMSP |
| MOL000449 | Stigmasterol | 412.77 | 43.83 | 0.76 | SDH, SZY, SY, ZX | TCMSP |
| MOL001494 | Mandenol | 308.56 | 42 | 0.19 | SZY | TCMSP |
| MOL001495 | Ethyl linolenate | 306.54 | 46.1 | 0.2 | SZY | TCMSP |
| MOL001771 | Poriferast-5-en-3beta-ol | 414.79 | 36.91 | 0.75 | SZY | TCMSP |
| MOL002879 | Diop | 390.62 | 43.59 | 0.39 | SZY | TCMSP |
| MOL002883 | Ethyl oleate (NF) | 310.58 | 32.4 | 0.19 | SZY | TCMSP |
| MOL000358 | Beta-sitosterol | 414.79 | 36.91 | 0.75 | SZY | TCMSP |
| MOL005481 | 2,6,10,14,18-pentamethylicosa-2,6,10,14.18-pentaene | 342.67 | 33.4 | 0.24 | SZY | TCMSP |
| MOL005503 | Cornudentanone | 378.56 | 39.66 | 0.33 | SZY | TCMSP, Taiwan, BATMAN-TCM |
| MOL005530 | Hydroxygenkwanin | 300.28 | 36.47 | 0.27 | SZY | TCMSP |
| MOL005531 | Telocinobufagin | 402.58 | 69.99 | 0.79 | SZY | TCMSP, Taiwan, BATMAN-TCM |
| MOL008457 | Tetrahydroalstonine | 352.47 | 32.42 | 0.81 | SZY | TCMSP, Taiwan, BATMAN-TCM |
| MOL000098 | Quercetin | 302.25 | 46.43 | 0.28 | MDP | TCMSP |
| MOL000211 | Betulinic acid | 456.78 | 55.38 | 0.78 | MDP | TCMSP |
| MOL000422 | Kaempferol | 286.25 | 41.88 | 0.24 | MDP | TCMSP |
| MOL000492 | (+)-Catechin | 290.29 | 54.83 | 0.24 | MDP | TCMSP |
| MOL007374 | 5-[[5-(4-methoxyphenyl)-2-furyl]methylene]barbituric acid | 312.3 | 43.44 | 0.3 | MDP | TCMSP |
| MOL001924 | Paeoniflorin | 480.51 | 53.87 | 0.79 | MDP, FL | BATMAN-TCM |
| MOL002222 | Sugiol | 300.48 | 36.11 | 0.28 | MDP | BATMAN-TCM, Taiwan |
| MOL001559 | Piperlonguminine | 273.36 | 30.71 | 0.18 | SY | TCMSP |
| MOL001736 | (-)-Taxifolin | 304.27 | 60.51 | 0.27 | SY | TCMSP |
| MOL000322 | Kadsurenone | 356.45 | 54.72 | 0.38 | SY | TCMSP |
| MOL005430 | Hancinone C | 400.51 | 59.05 | 0.39 | SY | TCMSP |
| MOL005435 | 24-Methylcholest-5-enyl-3belta-O-glucopyranoside_qt | 400.76 | 37.58 | 0.72 | SY | TCMSP |
| MOL005438 | Campesterol | 400.76 | 37.58 | 0.71 | SY | TCMSP, BATMAN-TCM |
| MOL005440 | Isofucosterol | 412.77 | 43.78 | 0.76 | SY | TCMSP |
| MOL005458 | Dioscoreside C_qt | 444.72 | 36.38 | 0.87 | SY | TCMSP |
| MOL000546 | Diosgenin | 414.69 | 80.88 | 0.81 | SY | TCMSP, BATMAN-TCM |
| MOL005465 | Aids180907 | 394.45 | 45.33 | 0.77 | SY | TCMSP |
| MOL000953 | Clr | 386.73 | 37.87 | 0.68 | SY | TCMSP |
| MOL004580 | Cis-Dihydroquercetin | 304.27 | 66.44 | 0.27 | SY | BATMAN-TCM |
| MOL000275 | Trametenolic acid | 456.78 | 38.71 | 0.8 | FL | TCMSP |
| MOL000279 | Cerevisterol | 430.74 | 37.96 | 0.77 | FL | TCMSP |
| MOL000282 | 5-dihydroergosterol | 398.74 | 43.51 | 0.72 | FL | TCMSP |
| MOL000283 | Ergosterol peroxide | 430.74 | 40.36 | 0.81 | FL | TCMSP |
| MOL000285 | Dehydrotumulosic acid | 482.77 | 38.26 | 0.82 | FL | TCMSP |
| MOL000296 | Hederagenin | 414.79 | 36.91 | 0.75 | FL | TCMSP |
| MOL000073 | Ent-Epicatechin | 290.29 | 48.96 | 0.24 | FL | Taiwan |
| MOL000830 | Alisol B | 472.78 | 34.47 | 0.82 | FL, ZX | Taiwan |
| MOL000831 | Alisol B monoacetate | 514.82 | 35.58 | 0.81 | ZX | TCMSP, Taiwan, BATMAN-TCM |
| MOL000849 | 16β-methoxyalisol B monoacetate | 544.85 | 32.43 | 0.77 | ZX | TCMSP |
| MOL000856 | Alisol C monoacetate | 514.77 | 33.06 | 0.83 | ZX | TCMSP |
| MOL002464 | 1-monolinolein | 354.59 | 37.18 | 0.3 | ZX | TCMSP |
| MOL000862 | Alisol B 23-acetate | 514.82 | 35.58 | 0.81 | FL, ZX | TCMSP, Taiwan |