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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C-C chemokine receptor type 53355 records.
| Compound ID | Source ID | Source Type | Compound Name | Molecular Weight | Molecular Formula | Molecular Species | |
|---|---|---|---|---|---|---|---|
| B037418 | CHEMBL1431 | Small molecule | METFORMIN | 129.17 | C4H11N5 | BASE | Details |
| B037962 | CHEMBL1433 | Small molecule | DOXYCYCLINE ANHYDROUS | 444.44 | C22H24N2O8 | ACID | Details |
| B039885 | CHEMBL1440 | Small molecule | TETRACYCLINE | 444.44 | C22H24N2O8 | ZWITTERION | Details |
| B040922 | CHEMBL1444 | Small molecule | LETROZOLE | 285.31 | C17H11N5 | NEUTRAL | Details |
| B041681 | CHEMBL1447 | Small molecule | LINCOMYCIN | 406.55 | C18H34N2O6S | NEUTRAL | Details |
| B042698 | CHEMBL1451 | Small molecule | TRIAMCINOLONE | 394.44 | C21H27FO6 | NEUTRAL | Details |
| B043523 | CHEMBL1454 | Small molecule | LEVAMISOLE | 204.3 | C11H12N2S | NEUTRAL | Details |
| B043780 | CHEMBL1454946 | Small molecule | FLUBENDAZOLE | 313.29 | C16H12FN3O3 | NEUTRAL | Details |
| B043795 | CHEMBL1455 | Small molecule | ALTRETAMINE | 210.28 | C9H18N6 | BASE | Details |
| B044048 | CHEMBL1456 | Small molecule | MYCOPHENOLATE MOFETIL | 433.5 | C23H31NO7 | NEUTRAL | Details |
| B044780 | CHEMBL1458880 | Small molecule | CADMIUM DICHLORIDE | 183.32 | CdCl2 | None | Details |
| B045076 | CHEMBL1460 | Small molecule | DIDANOSINE | 236.23 | C10H12N4O3 | NEUTRAL | Details |
| B045855 | CHEMBL1463 | Small molecule | FLUCYTOSINE | 129.09 | C4H4FN3O | NEUTRAL | Details |
| B046132 | CHEMBL1464 | Small molecule | WARFARIN | 308.33 | C19H16O4 | ACID | Details |
| B046647 | CHEMBL1466 | Small molecule | DICUMAROL | 336.3 | C19H12O6 | ACID | Details |
| B046874 | CHEMBL1467 | Small molecule | ALLOPURINOL | 136.11 | C5H4N4O | NEUTRAL | Details |
| B049015 | CHEMBL1475 | Small molecule | TRIOXSALEN | 228.25 | C14H12O3 | NEUTRAL | Details |
| B049559 | CHEMBL1476898 | Small molecule | CADMIUM ACETATE | 230.5 | C4H6CdO4 | None | Details |
| B049585 | CHEMBL1477 | Small molecule | CERIVASTATIN | 459.56 | C26H34FNO5 | ACID | Details |
| B050168 | CHEMBL1479 | Small molecule | DANAZOL | 337.46 | C22H27NO2 | NEUTRAL | Details |
| B050446 | CHEMBL1480 | Small molecule | FELODIPINE | 384.26 | C18H19Cl2NO4 | NEUTRAL | Details |
| B050682 | CHEMBL1480987 | Small molecule | CYCLANDELATE | 276.38 | C17H24O3 | NEUTRAL | Details |
| B050688 | CHEMBL1481 | Small molecule | GLIMEPIRIDE | 490.63 | C24H34N4O5S | ACID | Details |
| B051242 | CHEMBL1483 | Small molecule | ALBENDAZOLE | 265.34 | C12H15N3O2S | NEUTRAL | Details |
| B052288 | CHEMBL1487 | Small molecule | ATORVASTATIN | 558.65 | C33H35FN2O5 | ACID | Details |
| B052813 | CHEMBL1489 | Small molecule | AZACITIDINE | 244.21 | C8H12N4O5 | NEUTRAL | Details |
| B052878 | CHEMBL1489254 | Small molecule | TRIACETIN | 218.21 | C9H14O6 | NEUTRAL | Details |
| B053073 | CHEMBL1490 | Small molecule | TRIHEXYPHENIDYL | 301.47 | C20H31NO | BASE | Details |
| B053346 | CHEMBL1491 | Small molecule | AMLODIPINE | 408.88 | C20H25ClN2O5 | BASE | Details |
| B053880 | CHEMBL1493 | Small molecule | FLAVOXATE | 391.47 | C24H25NO4 | NEUTRAL | Details |
| B055507 | CHEMBL1499 | Small molecule | -- | 360.45 | C21H28O5 | NEUTRAL | Details |
| B056010 | CHEMBL1501 | Small molecule | FLUOCINONIDE | 494.53 | C26H32F2O7 | NEUTRAL | Details |
| B056281 | CHEMBL1502 | Small molecule | PANTOPRAZOLE | 383.38 | C16H15F2N3O4S | NEUTRAL | Details |
| B056551 | CHEMBL1503 | Small molecule | OMEPRAZOLE | 345.42 | C17H19N3O3S | NEUTRAL | Details |
| B056824 | CHEMBL1504 | Small molecule | TRIAMCINOLONE ACETONIDE | 434.5 | C24H31FO6 | NEUTRAL | Details |
| B058908 | CHEMBL1512 | Small molecule | FLUNISOLIDE | 434.5 | C24H31FO6 | NEUTRAL | Details |
| B059177 | CHEMBL1513 | Small molecule | IRBESARTAN | 428.54 | C25H28N6O | ACID | Details |
| B059715 | CHEMBL1515 | Small molecule | METHIMAZOLE | 114.17 | C4H6N2S | NEUTRAL | Details |
| B059910 | CHEMBL1515611 | Small molecule | BROMISOVALUM | 223.07 | C6H11BrN2O2 | NEUTRAL | Details |
| B060284 | CHEMBL1517 | Small molecule | OXYTETRACYCLINE | 460.44 | C22H24N2O9 | ACID | Details |
| B060575 | CHEMBL1518 | Small molecule | PROPYLTHIOURACIL | 170.24 | C7H10N2OS | NEUTRAL | Details |
| B061381 | CHEMBL1521 | Small molecule | ZALEPLON | 305.34 | C17H15N5O | NEUTRAL | Details |
| B062289 | CHEMBL15245 | Small molecule | YOHIMBINE | 354.45 | C21H26N2O3 | NEUTRAL | Details |
| B063092 | CHEMBL1527608 | Small molecule | DOXOFYLLINE | 266.26 | C11H14N4O4 | NEUTRAL | Details |
| B063863 | CHEMBL153062 | Small molecule | 4-NONYLPHENOL | 220.36 | C15H24O | NEUTRAL | Details |
| B064965 | CHEMBL153479 | Small molecule | AMBROXOL | 378.11 | C13H18Br2N2O | BASE | Details |
| B065024 | CHEMBL1535 | Small molecule | HYDROXYCHLOROQUINE | 335.88 | C18H26ClN3O | BASE | Details |
| B065296 | CHEMBL1536 | Small molecule | ERGOCALCIFEROL | 396.66 | C28H44O | NEUTRAL | Details |
| B065551 | CHEMBL1537 | Small molecule | AZLOCILLIN | 461.5 | C20H23N5O6S | ACID | Details |
| B066054 | CHEMBL1539 | Small molecule | SULFADOXINE | 310.34 | C12H14N4O4S | ACID | Details |
| B066322 | CHEMBL154 | Small molecule | NAPROXEN | 230.26 | C14H14O3 | ACID | Details |
| B066323 | CHEMBL1540 | Small molecule | PENCICLOVIR | 253.26 | C10H15N5O3 | NEUTRAL | Details |
| B066643 | CHEMBL154111 | Small molecule | SALSALATE | 258.23 | C14H10O5 | ACID | Details |
| B066883 | CHEMBL1542 | Small molecule | AZATHIOPRINE | 277.27 | C9H7N7O2S | NEUTRAL | Details |
| B067378 | CHEMBL1544 | Small molecule | LIOTHYRONINE | 650.98 | C15H12I3NO4 | ZWITTERION | Details |
| B069222 | CHEMBL15511 | Small molecule | ENROFLOXACIN | 359.4 | C19H22FN3O3 | ACID | Details |
| B070014 | CHEMBL1554 | Protein | DACTINOMYCIN | 1255.44 | C62H86N12O16 | None | Details |
| B071618 | CHEMBL1560 | Small molecule | CAPTOPRIL | 217.29 | C9H15NO3S | ACID | Details |
| B072780 | CHEMBL156455 | Small molecule | 1,1-DICHLOROETHENE | 96.94 | C2H2Cl2 | None | Details |
| B073137 | CHEMBL1566 | Oligosaccharide | ACARBOSE | 645.61 | C25H43NO18 | NEUTRAL | Details |
| B073196 | CHEMBL1566249 | Small molecule | AMPIROXICAM | 447.47 | C20H21N3O7S | NEUTRAL | Details |
| B073399 | CHEMBL1566956 | Small molecule | TROXIPIDE | 294.35 | C15H22N2O4 | BASE | Details |
| B073536 | CHEMBL1567463 | Small molecule | CHOLINE ALFOSCERATE | 257.22 | C8H20NO6P | ACID | Details |
| B073678 | CHEMBL1568 | Small molecule | FLUDARABINE | 285.24 | C10H12FN5O4 | NEUTRAL | Details |
| B074463 | CHEMBL157101 | Small molecule | KETOCONAZOLE | 531.44 | C26H28Cl2N4O4 | NEUTRAL | Details |
| B074550 | CHEMBL157138 | Small molecule | LISURIDE | 338.46 | C20H26N4O | NEUTRAL | Details |
| B074690 | CHEMBL1572 | Small molecule | NETILMICIN | 475.59 | C21H41N5O7 | BASE | Details |
| B075430 | CHEMBL157491 | Small molecule | -- | 588.75 | C34H44N4O5 | BASE | Details |
| B075565 | CHEMBL157548 | Small molecule | DANOFLOXACIN | 357.39 | C19H20FN3O3 | ACID | Details |
| B075940 | CHEMBL15770 | Small molecule | SULINDAC | 356.42 | C20H17FO3S | ACID | Details |
| B076640 | CHEMBL157983 | Small molecule | -- | 588.75 | C34H44N4O5 | BASE | Details |
| B076677 | CHEMBL158 | Small molecule | AZTREONAM | 435.44 | C13H17N5O8S2 | ACID | Details |
| B077853 | CHEMBL158438 | Small molecule | -- | 539.72 | C34H41N3O3 | BASE | Details |
| B078255 | CHEMBL1586 | Small molecule | BECLOMETHASONE | 408.92 | C22H29ClO5 | NEUTRAL | Details |
| B078637 | CHEMBL158754 | Small molecule | -- | 596.73 | C35H40N4O5 | BASE | Details |
| B079281 | CHEMBL159 | Small molecule | VINBLASTINE | 810.99 | C46H58N4O9 | BASE | Details |
| B079325 | CHEMBL159018 | Small molecule | -- | 472.72 | C32H44N2O | BASE | Details |
| B079549 | CHEMBL159097 | Small molecule | -- | 438.62 | C30H34N2O | BASE | Details |
| B079838 | CHEMBL1592 | Small molecule | QUINAPRIL | 438.52 | C25H30N2O5 | ACID | Details |
| B081540 | CHEMBL1598608 | Small molecule | AZASETRON | 349.82 | C17H20ClN3O3 | NEUTRAL | Details |
| B081918 | CHEMBL16 | Small molecule | PHENYTOIN | 252.27 | C15H12N2O2 | ACID | Details |
| B081919 | CHEMBL160 | Protein | CYCLOSPORINE | 1202.63 | C62H111N11O12 | None | Details |
| B082365 | CHEMBL1601669 | Small molecule | ALFACALCIDOL | 400.65 | C27H44O2 | NEUTRAL | Details |
| B083653 | CHEMBL16068 | Small molecule | BROMOBENZENE | 157.01 | C6H5Br | None | Details |
| B083786 | CHEMBL16073 | Small molecule | PHENACETIN | 179.22 | C10H13NO2 | NEUTRAL | Details |
| B084695 | CHEMBL161093 | Small molecule | -- | 480.7 | C33H40N2O | BASE | Details |
| B084976 | CHEMBL1612004 | Small molecule | -- | 123.15 | C7H9NO | NEUTRAL | Details |
| B085427 | CHEMBL1614641 | Small molecule | FLUNOXAPROFEN | 285.27 | C16H12FNO3 | ACID | Details |
| B085434 | CHEMBL161480 | Small molecule | -- | 531.74 | C33H45N3O3 | BASE | Details |
| B085442 | CHEMBL161587 | Small molecule | -- | 528.5 | C26H34BrN5O2 | BASE | Details |
| B085443 | CHEMBL161594 | Small molecule | -- | 438.62 | C30H34N2O | BASE | Details |
| B085447 | CHEMBL161664 | Small molecule | -- | 557.53 | C28H37BrN4O3 | BASE | Details |
| B085453 | CHEMBL1618305 | Small molecule | NALOXONAZINE | 650.78 | C38H42N4O6 | BASE | Details |
| B085454 | CHEMBL1618631 | Small molecule | -- | 334.26 | C17H20BrNO | BASE | Details |
| B085455 | CHEMBL1619 | Small molecule | CLADRIBINE | 285.69 | C10H12ClN5O3 | NEUTRAL | Details |
| B085461 | CHEMBL1621896 | Small molecule | -- | 395.34 | C19H27BrN2O2 | NEUTRAL | Details |
| B085466 | CHEMBL1623307 | Small molecule | -- | 364.28 | C18H22BrNO2 | NEUTRAL | Details |
| B085468 | CHEMBL1623498 | Small molecule | -- | 212.21 | C12H8N2O2 | NEUTRAL | Details |
| B085479 | CHEMBL1626 | Small molecule | CLEMASTINE | 343.9 | C21H26ClNO | BASE | Details |
| B085484 | CHEMBL1628227 | Small molecule | DOXEPIN | 279.38 | C19H21NO | BASE | Details |