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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Fatty acid synthase2193 records.
Compound ID | Source ID | Source Type | Compound Name | Molecular Weight | Molecular Formula | Molecular Species | |
---|---|---|---|---|---|---|---|
B000787 | CHEMBL1090448 | Small molecule | -- | 414.32 | C20H14O10 | NEUTRAL | Details |
B000963 | CHEMBL1093743 | Small molecule | -- | 280.45 | C18H32O2 | ACID | Details |
B001920 | CHEMBL1219 | Small molecule | RABEPRAZOLE | 359.45 | C18H21N3O3S | NEUTRAL | Details |
B002077 | CHEMBL1224332 | Small molecule | CUDRAXANTHONE | 326.35 | C19H18O5 | NEUTRAL | Details |
B002155 | CHEMBL1235157 | Small molecule | PENTABROMOPHENOL | 488.59 | C6HBr5O | ACID | Details |
B002344 | CHEMBL1255589 | Small molecule | LORGLUMIDE SODIUM | 481.4 | C22H31Cl2N2NaO4 | ACID | Details |
B002345 | CHEMBL1255647 | Small molecule | -- | 276.12 | C9H2N4Na2O4 | NEUTRAL | Details |
B002373 | CHEMBL1256379 | Small molecule | -- | 246.22 | C13H10O5 | NEUTRAL | Details |
B002374 | CHEMBL1256380 | Small molecule | -- | 262.22 | C13H10O6 | NEUTRAL | Details |
B002443 | CHEMBL1257642 | Small molecule | NEOSMITILBIN | 450.4 | C21H22O11 | NEUTRAL | Details |
B002746 | CHEMBL129482 | Small molecule | (+)-EPICATECHIN | 290.27 | C15H14O6 | NEUTRAL | Details |
B002907 | CHEMBL1299768 | Small molecule | -- | 330.34 | C17H18N2O5 | NEUTRAL | Details |
B002932 | CHEMBL1299881 | Small molecule | -- | 464.5 | C23H20N4O5S | NEUTRAL | Details |
B003064 | CHEMBL1300420 | Small molecule | -- | 273.3 | C17H11N3O | NEUTRAL | Details |
B003074 | CHEMBL1300461 | Small molecule | -- | 328.37 | C18H20N2O4 | NEUTRAL | Details |
B003354 | CHEMBL1301503 | Small molecule | -- | 403.4 | C21H17N5O4 | NEUTRAL | Details |
B003525 | CHEMBL1302152 | Small molecule | -- | 334.36 | C14H14N4O4S | NEUTRAL | Details |
B003719 | CHEMBL1302894 | Small molecule | -- | 533.38 | C26H18Cl2N6O3 | NEUTRAL | Details |
B003824 | CHEMBL1303373 | Small molecule | -- | 341.75 | C17H12ClN3O3 | NEUTRAL | Details |
B004234 | CHEMBL1304974 | Small molecule | -- | 488.55 | C25H16N2O5S2 | ACID | Details |
B004575 | CHEMBL1306247 | Small molecule | -- | 371.42 | C18H17N3O4S | NEUTRAL | Details |
B004731 | CHEMBL1306827 | Small molecule | -- | 381.5 | C18H27N3O4S | NEUTRAL | Details |
B004788 | CHEMBL1307059 | Small molecule | -- | 553.66 | C26H43N5O8 | NEUTRAL | Details |
B004797 | CHEMBL1307099 | Small molecule | -- | 344.76 | C16H13ClN4O3 | NEUTRAL | Details |
B005139 | CHEMBL1308404 | Small molecule | -- | 306.67 | C12H7ClN4O4 | NEUTRAL | Details |
B005304 | CHEMBL1309098 | Small molecule | -- | 400.86 | C21H21ClN2O4 | NEUTRAL | Details |
B005600 | CHEMBL1310165 | Small molecule | -- | 382.84 | C18H23ClN2O5 | ACID | Details |
B005641 | CHEMBL1310297 | Small molecule | -- | 355.44 | C17H13N3O2S2 | NEUTRAL | Details |
B006104 | CHEMBL1312152 | Small molecule | -- | 455.25 | C18H16Cl2N4O6 | NEUTRAL | Details |
B006159 | CHEMBL1312317 | Small molecule | -- | 477.47 | C25H23N3O7 | NEUTRAL | Details |
B006190 | CHEMBL1312434 | Small molecule | -- | 349.77 | C16H16ClN3O4 | NEUTRAL | Details |
B006253 | CHEMBL1312660 | Small molecule | -- | 391.38 | C21H17N3O5 | NEUTRAL | Details |
B006715 | CHEMBL1314444 | Small molecule | -- | 498.49 | C28H22N2O7 | ACID | Details |
B007154 | CHEMBL1316088 | Small molecule | -- | 454.27 | C19H17Cl2N3O6 | NEUTRAL | Details |
B007167 | CHEMBL1316155 | Small molecule | -- | 306.32 | C15H18N2O5 | None | Details |
B007507 | CHEMBL1317422 | Small molecule | -- | 438.52 | C25H30N2O5 | NEUTRAL | Details |
B007508 | CHEMBL1317429 | Small molecule | -- | 562.45 | C30H25Cl2N3O4 | NEUTRAL | Details |
B007522 | CHEMBL1317481 | Small molecule | -- | 391.42 | C19H25N3O6 | NEUTRAL | Details |
B007591 | CHEMBL1317733 | Small molecule | -- | 439.5 | C21H21N5O4S | NEUTRAL | Details |
B007763 | CHEMBL1318412 | Small molecule | -- | 313.74 | C16H12ClN3O2 | NEUTRAL | Details |
B007786 | CHEMBL1318520 | Small molecule | -- | 524.08 | C29H30ClNO4S | ACID | Details |
B007822 | CHEMBL1318689 | Small molecule | -- | 346.38 | C18H22N2O5 | None | Details |
B007866 | CHEMBL1318856 | Small molecule | -- | 374.19 | C16H12BrN3O3 | NEUTRAL | Details |
B007900 | CHEMBL1318983 | Small molecule | -- | 414.33 | C19H14N2O9 | NEUTRAL | Details |
B007956 | CHEMBL1319242 | Small molecule | -- | 457.51 | C22H23N3O6S | NEUTRAL | Details |
B007978 | CHEMBL1319307 | Small molecule | -- | 588.9 | C19H11ClF6N4O5S2 | ACID | Details |
B008130 | CHEMBL1319867 | Small molecule | -- | 306.67 | C12H7ClN4O4 | NEUTRAL | Details |
B008259 | CHEMBL1320393 | Small molecule | -- | 440.91 | C22H17ClN2O4S | ACID | Details |
B008321 | CHEMBL1320628 | Small molecule | -- | 337.78 | C12H7ClF3NOS2 | NEUTRAL | Details |
B008338 | CHEMBL1320688 | Small molecule | -- | 356.38 | C19H20N2O5 | NEUTRAL | Details |
B008350 | CHEMBL1320737 | Small molecule | -- | 492.51 | C21H24N4O8S | NEUTRAL | Details |
B008385 | CHEMBL1320856 | Small molecule | -- | 351.36 | C19H17N3O4 | NEUTRAL | Details |
B008468 | CHEMBL1321159 | Small molecule | -- | 301.37 | C15H15N3O2S | NEUTRAL | Details |
B008678 | CHEMBL1322014 | Small molecule | -- | 521.57 | C27H31N5O6 | NEUTRAL | Details |
B008681 | CHEMBL1322023 | Small molecule | -- | 430.46 | C22H26N2O7 | NEUTRAL | Details |
B008926 | CHEMBL1322986 | Small molecule | -- | 363.8 | C17H18ClN3O4 | NEUTRAL | Details |
B009019 | CHEMBL1323328 | Small molecule | -- | 489.62 | C23H27N3O5S2 | NEUTRAL | Details |
B009265 | CHEMBL1324243 | Small molecule | -- | 372.22 | C13H8F8N4 | NEUTRAL | Details |
B009272 | CHEMBL1324275 | Small molecule | -- | 324.31 | C15H17FN2O5 | NEUTRAL | Details |
B009323 | CHEMBL1324475 | Small molecule | -- | 312.36 | C15H15F3N2S | NEUTRAL | Details |
B009348 | CHEMBL1324563 | Small molecule | -- | 459.55 | C21H21N3O5S2 | NEUTRAL | Details |
B009547 | CHEMBL1325376 | Small molecule | -- | 381.41 | C20H15NO5S | NEUTRAL | Details |
B009627 | CHEMBL1325663 | Small molecule | -- | 397.74 | C17H11ClF3N3O3 | NEUTRAL | Details |
B009687 | CHEMBL1325909 | Small molecule | -- | 376.87 | C18H17ClN2O3S | NEUTRAL | Details |
B009863 | CHEMBL1326530 | Small molecule | -- | 313.29 | C16H12FN3O3 | NEUTRAL | Details |
B009935 | CHEMBL1326841 | Small molecule | -- | 469.56 | C24H27N3O5S | NEUTRAL | Details |
B010041 | CHEMBL1327228 | Small molecule | -- | 459.44 | C19H17N5O7S | NEUTRAL | Details |
B010083 | CHEMBL1327417 | Small molecule | -- | 363.35 | C16H13NO7S | NEUTRAL | Details |
B010113 | CHEMBL1327543 | Small molecule | -- | 478.3 | C20H20BrN3O6 | NEUTRAL | Details |
B010117 | CHEMBL1327548 | Small molecule | -- | 429.9 | C22H24ClN3O4 | NEUTRAL | Details |
B010131 | CHEMBL1327617 | Small molecule | -- | 427.98 | C18H22ClN3O3S2 | NEUTRAL | Details |
B010152 | CHEMBL1327721 | Small molecule | -- | 403.45 | C16H13N5O4S2 | NEUTRAL | Details |
B010316 | CHEMBL1328328 | Small molecule | -- | 497.53 | C23H23N5O6S | NEUTRAL | Details |
B010621 | CHEMBL1329557 | Small molecule | -- | 358.74 | C16H11ClN4O4 | NEUTRAL | Details |
B010838 | CHEMBL1330386 | Small molecule | -- | 472.59 | C22H24N4O4S2 | NEUTRAL | Details |
B010913 | CHEMBL1330657 | Small molecule | -- | 345.47 | C18H23N3O2S | NEUTRAL | Details |
B011150 | CHEMBL1331561 | Small molecule | -- | 321.29 | C14H8FNO5S | None | Details |
B011378 | CHEMBL1332454 | Small molecule | -- | 480.96 | C19H17ClN4O5S2 | NEUTRAL | Details |
B011481 | CHEMBL1332795 | Small molecule | -- | 422.49 | C23H26N4O4 | BASE | Details |
B011547 | CHEMBL1333046 | Small molecule | -- | 305.33 | C15H19N3O4 | NEUTRAL | Details |
B011681 | CHEMBL1333510 | Small molecule | -- | 379.85 | C15H10ClN3O3S2 | NEUTRAL | Details |
B011874 | CHEMBL1334185 | Small molecule | -- | 345.79 | C17H16ClN3O3 | NEUTRAL | Details |
B012155 | CHEMBL1335218 | Small molecule | -- | 431.42 | C21H22FN3O6 | NEUTRAL | Details |
B012280 | CHEMBL1335664 | Small molecule | -- | 376.41 | C22H20N2O4 | NEUTRAL | Details |
B012745 | CHEMBL1337370 | Small molecule | -- | 470.55 | C24H26N2O6S | NEUTRAL | Details |
B012783 | CHEMBL1337525 | Small molecule | -- | 356.43 | C13H16N4O4S2 | NEUTRAL | Details |
B012833 | CHEMBL1337686 | Small molecule | -- | 357.37 | C18H19N3O5 | NEUTRAL | Details |
B012855 | CHEMBL1337766 | Small molecule | -- | 292.29 | C14H16N2O5 | NEUTRAL | Details |
B013157 | CHEMBL1338924 | Small molecule | -- | 445.43 | C24H19N3O6 | ACID | Details |
B013167 | CHEMBL1338958 | Small molecule | -- | 437.56 | C21H31N3O5S | NEUTRAL | Details |
B013352 | CHEMBL1339606 | Small molecule | -- | 426.49 | C22H22N2O5S | NEUTRAL | Details |
B013404 | CHEMBL1339761 | Small molecule | -- | 415.4 | C20H21N3O7 | NEUTRAL | Details |
B013605 | CHEMBL1340504 | Small molecule | -- | 368.31 | C17H12N4O6 | NEUTRAL | Details |
B013641 | CHEMBL1340633 | Small molecule | -- | 484.51 | C28H24N2O6 | ACID | Details |
B013682 | CHEMBL1340786 | Small molecule | -- | 419.82 | C19H18ClN3O6 | NEUTRAL | Details |
B013696 | CHEMBL1340854 | Small molecule | -- | 397.43 | C21H23N3O5 | NEUTRAL | Details |
B013819 | CHEMBL1341327 | Small molecule | -- | 470.55 | C24H26N2O6S | NEUTRAL | Details |
B013856 | CHEMBL1341456 | Small molecule | -- | 484.58 | C24H28N4O5S | NEUTRAL | Details |
B013989 | CHEMBL1341981 | Small molecule | -- | 423.54 | C20H29N3O5S | NEUTRAL | Details |
B014083 | CHEMBL1342320 | Small molecule | -- | 318.76 | C16H15ClN2O3 | NEUTRAL | Details |