Bioactive Compounds
Drug-like bioactive compounds for NAFLD-related targets (i.e., therapeutic targets in NAFLDkb) are extracted from ChEMBL. Detailed information and structure for each compound are provided, along with knowledge graphs linked with related therapeutic targets.
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Thyroid hormone receptor beta6296 records.
| Compound ID | Source ID | Source Type | Compound Name | Molecular Weight | Molecular Formula | Molecular Species | |
|---|---|---|---|---|---|---|---|
| B144148 | CHEMBL585 | Small molecule | TRIAMTERENE | 253.27 | C12H11N7 | NEUTRAL | Details |
| B144167 | CHEMBL58547 | Protein | IPAMORELIN | 711.87 | C38H49N9O5 | BASE | Details |
| B144195 | CHEMBL586005 | Small molecule | -- | 507.59 | C30H29N5O3 | NEUTRAL | Details |
| B144209 | CHEMBL586982 | Small molecule | -- | 344.75 | C17H13ClN2O4 | NEUTRAL | Details |
| B144260 | CHEMBL589366 | Small molecule | 3R14S-OCHRATOXIN A | 403.82 | C20H18ClNO6 | ACID | Details |
| B144366 | CHEMBL591628 | Small molecule | -- | 306.37 | C19H18N2O2 | NEUTRAL | Details |
| B144387 | CHEMBL59201 | Small molecule | -- | 571.61 | C26H42N3O9P | ACID | Details |
| B144396 | CHEMBL592124 | Small molecule | -- | 424.51 | C20H16N4O3S2 | NEUTRAL | Details |
| B144479 | CHEMBL594024 | Small molecule | -- | 474.28 | C22H14Cl2FN3O4 | NEUTRAL | Details |
| B144480 | CHEMBL594025 | Small molecule | -- | 433.44 | C24H20FN3O4 | ACID | Details |
| B144482 | CHEMBL594047 | Small molecule | -- | 467.93 | C21H22ClNO7S | ACID | Details |
| B144551 | CHEMBL596350 | Small molecule | -- | 525.35 | C25H18Cl2N4O5 | NEUTRAL | Details |
| B144570 | CHEMBL597242 | Small molecule | -- | 328.39 | C17H16N2O3S | NEUTRAL | Details |
| B144607 | CHEMBL599013 | Small molecule | -- | 385.38 | C22H15N3O4 | ACID | Details |
| B144615 | CHEMBL599307 | Small molecule | -- | 530.69 | C27H38N4O5S | NEUTRAL | Details |
| B144627 | CHEMBL6 | Small molecule | INDOMETHACIN | 357.79 | C19H16ClNO4 | ACID | Details |
| B144628 | CHEMBL600 | Small molecule | ACETYLCYSTEINE | 163.2 | C5H9NO3S | ACID | Details |
| B144629 | CHEMBL600008 | Small molecule | -- | 253.26 | C15H11NO3 | NEUTRAL | Details |
| B144705 | CHEMBL601952 | Small molecule | -- | 226.75 | C12H19ClN2 | NEUTRAL | Details |
| B144743 | CHEMBL602561 | Small molecule | -- | 346.18 | C16H12BrNO3 | NEUTRAL | Details |
| B144771 | CHEMBL602969 | Small molecule | -- | 252.36 | C17H20N2 | NEUTRAL | Details |
| B144772 | CHEMBL602970 | Small molecule | -- | 234.28 | C11H10N2O2S | NEUTRAL | Details |
| B144775 | CHEMBL603024 | Small molecule | -- | 404.9 | C24H21ClN2O2 | NEUTRAL | Details |
| B144900 | CHEMBL608990 | Small molecule | -- | 341.36 | C19H19NO5 | ACID | Details |
| B144916 | CHEMBL610198 | Small molecule | -- | 241.08 | C10H6Cl2N2O | None | Details |
| B144934 | CHEMBL614 | Small molecule | PYRAZINAMIDE | 123.11 | C5H5N3O | NEUTRAL | Details |
| B144942 | CHEMBL61593 | Small molecule | CYCLOTHIAZIDE | 389.89 | C14H16ClN3O4S2 | NEUTRAL | Details |
| B144949 | CHEMBL62136 | Small molecule | T091317 | 481.34 | C17H12F9NO3S | NEUTRAL | Details |
| B144960 | CHEMBL6246 | Small molecule | ELLAGIC ACID | 302.19 | C14H6O8 | ACID | Details |
| B144961 | CHEMBL625 | Small molecule | THIABENDAZOLE | 201.25 | C10H7N3S | NEUTRAL | Details |
| B144974 | CHEMBL632 | Small molecule | BETAMETHASONE | 392.47 | C22H29FO5 | NEUTRAL | Details |
| B144975 | CHEMBL633 | Small molecule | AMIODARONE | 645.32 | C25H29I2NO3 | NEUTRAL | Details |
| B144977 | CHEMBL63354 | Small molecule | AMENTOFLAVONE | 538.46 | C30H18O10 | ACID | Details |
| B145005 | CHEMBL6466 | Small molecule | COUMARIN | 146.14 | C9H6O2 | None | Details |
| B145016 | CHEMBL64894 | Small molecule | GENTIAN VIOLET | 407.99 | C25H30ClN3 | NEUTRAL | Details |
| B145020 | CHEMBL6497 | Small molecule | -- | 242.23 | C10H14N2O5 | NEUTRAL | Details |
| B145029 | CHEMBL65374 | Small molecule | -- | 308.29 | C17H12N2O4 | NEUTRAL | Details |
| B145048 | CHEMBL6608 | Small molecule | -- | 543.53 | C27H29NO11 | BASE | Details |
| B145062 | CHEMBL66953 | Small molecule | PURPUROGALLIN | 220.18 | C11H8O5 | NEUTRAL | Details |
| B145065 | CHEMBL67166 | Small molecule | SPHINGOSINE | 299.5 | C18H37NO2 | BASE | Details |
| B145084 | CHEMBL68000 | Small molecule | -- | 422.87 | C23H22ClF3O2 | None | Details |
| B145090 | CHEMBL683 | Small molecule | CLOFIBRIC ACID | 214.65 | C10H11ClO3 | ACID | Details |
| B145112 | CHEMBL692 | Small molecule | GLYCERIN | 92.09 | C3H8O3 | NEUTRAL | Details |
| B145121 | CHEMBL69612 | Small molecule | -- | 282.3 | C10H6N2O4S2 | ACID | Details |
| B145129 | CHEMBL69863 | Small molecule | PICEATANNOL | 244.25 | C14H12O4 | NEUTRAL | Details |
| B145145 | CHEMBL704 | Small molecule | MESALAMINE | 153.14 | C7H7NO3 | ACID | Details |
| B145166 | CHEMBL70971 | Small molecule | CARBENDAZIM | 191.19 | C9H9N3O2 | NEUTRAL | Details |
| B145209 | CHEMBL72365 | Small molecule | -- | 520.95 | C15H8Br2INO2 | ACID | Details |
| B145226 | CHEMBL7301 | Small molecule | FENRETINIDE | 391.56 | C26H33NO2 | NEUTRAL | Details |
| B145227 | CHEMBL7303 | Small molecule | ARECOLINE | 155.2 | C8H13NO2 | NEUTRAL | Details |
| B145229 | CHEMBL73234 | Small molecule | CARBETAPENTANE | 333.47 | C20H31NO3 | BASE | Details |
| B145236 | CHEMBL73930 | Small molecule | TANGERETIN | 372.37 | C20H20O7 | NEUTRAL | Details |
| B145278 | CHEMBL757 | Small molecule | NANDROLONE | 274.4 | C18H26O2 | NEUTRAL | Details |
| B145282 | CHEMBL75967 | Small molecule | PENTACHLOROPHENOL | 266.34 | C6HCl5O | ACID | Details |
| B145301 | CHEMBL76897 | Small molecule | 4-DAMP | 451.35 | C21H26INO2 | NEUTRAL | Details |
| B145311 | CHEMBL772 | Small molecule | RESERPINE | 608.69 | C33H40N2O9 | NEUTRAL | Details |
| B145327 | CHEMBL7763 | Small molecule | -- | 581.58 | C21H39N7O12 | BASE | Details |
| B145347 | CHEMBL786 | Small molecule | TAMOXIFEN CITRATE | 563.65 | C32H37NO8 | BASE | Details |
| B145351 | CHEMBL789 | Small molecule | RATHYRONINE | 650.98 | C15H12I3NO4 | ZWITTERION | Details |
| B145353 | CHEMBL790 | Small molecule | CHLORHEXIDINE | 505.46 | C22H30Cl2N10 | BASE | Details |
| B145388 | CHEMBL803 | Small molecule | CYTARABINE | 243.22 | C9H13N3O5 | NEUTRAL | Details |
| B145421 | CHEMBL8145 | Small molecule | DAIDZEIN | 254.24 | C15H10O4 | ACID | Details |
| B145447 | CHEMBL8234 | Protein | ENKEPHALIN | 555.63 | C28H37N5O7 | ACID | Details |
| B145450 | CHEMBL8260 | Small molecule | BAICALEIN | 270.24 | C15H10O5 | NEUTRAL | Details |
| B145459 | CHEMBL82970 | Small molecule | SALICYLANILIDE | 213.24 | C13H11NO2 | NEUTRAL | Details |
| B145466 | CHEMBL83154 | Small molecule | 2-AMINOANTHRACENE | 193.25 | C14H11N | NEUTRAL | Details |
| B145515 | CHEMBL84685 | Small molecule | -- | 223.23 | C14H9NO2 | NEUTRAL | Details |
| B145517 | CHEMBL84844 | Small molecule | DEOXYMANNOJIRIMYCIN | 163.17 | C6H13NO4 | NEUTRAL | Details |
| B145518 | CHEMBL849 | Small molecule | TRICLOSAN | 289.55 | C12H7Cl3O2 | NEUTRAL | Details |
| B145522 | CHEMBL85109 | Small molecule | ORTHOTOLIDINE | 212.3 | C14H16N2 | NEUTRAL | Details |
| B145524 | CHEMBL853 | Small molecule | ZALCITABINE | 211.22 | C9H13N3O3 | NEUTRAL | Details |
| B145531 | CHEMBL8597 | Small molecule | ASCOMYCIN | 792.02 | C43H69NO12 | NEUTRAL | Details |
| B145550 | CHEMBL869 | Small molecule | NITROFURAZONE | 198.14 | C6H6N4O4 | NEUTRAL | Details |
| B145563 | CHEMBL87426 | Small molecule | -- | 189.17 | C10H7NO3 | NEUTRAL | Details |
| B145565 | CHEMBL87568 | Small molecule | -- | 268.28 | C14H12N4O2 | NEUTRAL | Details |
| B145566 | CHEMBL876 | Small molecule | MECLOFENAMATE SODIUM | 318.14 | C14H10Cl2NNaO2 | ACID | Details |
| B145587 | CHEMBL88584 | Small molecule | -- | 376.39 | C16H16N4O5S | ACID | Details |
| B145634 | CHEMBL90039 | Small molecule | BENZOPHENONE | 182.22 | C13H10O | None | Details |
| B145691 | CHEMBL9113 | Small molecule | TOLUENE | 92.14 | C7H8 | None | Details |
| B145692 | CHEMBL91153 | Small molecule | 3',4'-DIMETHOXYFLAVONE | 282.3 | C17H14O4 | NEUTRAL | Details |
| B145725 | CHEMBL92024 | Small molecule | N-HYDROXYMETHYLNICOTINAMIDE | 152.15 | C7H8N2O2 | NEUTRAL | Details |
| B145760 | CHEMBL932 | Small molecule | DIPYRIDAMOLE | 504.64 | C24H40N8O4 | NEUTRAL | Details |
| B145786 | CHEMBL94007 | Small molecule | ETHACRIDINE | 253.31 | C15H15N3O | BASE | Details |
| B145795 | CHEMBL942 | Small molecule | BISACODYL | 361.4 | C22H19NO4 | NEUTRAL | Details |
| B145802 | CHEMBL9470 | Small molecule | SHIKONIN | 288.3 | C16H16O5 | NEUTRAL | Details |
| B145818 | CHEMBL95770 | Small molecule | 4-METHOXYCINNAMIC ACID | 178.19 | C10H10O3 | ACID | Details |
| B145821 | CHEMBL96 | Small molecule | GAMMA-AMINOBUTYRIC ACID | 103.12 | C4H9NO2 | ZWITTERION | Details |
| B145822 | CHEMBL960 | Small molecule | LEFLUNOMIDE | 270.21 | C12H9F3N2O2 | NEUTRAL | Details |
| B145832 | CHEMBL9637 | Small molecule | -- | 260.32 | C13H12N2O2S | ZWITTERION | Details |
| B145843 | CHEMBL97187 | Small molecule | -- | 464.56 | C28H32O6 | ACID | Details |
| B145845 | CHEMBL97453 | Small molecule | WEDELOLACTONE | 314.25 | C16H10O7 | NEUTRAL | Details |
| B145851 | CHEMBL97613 | Small molecule | -- | 368.47 | C23H28O4 | ACID | Details |
| B145859 | CHEMBL98135 | Small molecule | -- | 386.49 | C23H30O5 | ACID | Details |
| B145860 | CHEMBL98245 | Small molecule | -- | 342.38 | C17H14N2O4S | NEUTRAL | Details |
| B145866 | CHEMBL9850 | Small molecule | -- | 268.23 | C10H12N4O5 | NEUTRAL | Details |
| B145872 | CHEMBL991 | Small molecule | STAVUDINE | 224.22 | C10H12N2O4 | NEUTRAL | Details |