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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Peroxisome proliferator-activated receptor delta3381 records.
| Compound ID | Source ID | Source Type | Compound Name | Molecular Weight | Molecular Formula | Molecular Species | |
|---|---|---|---|---|---|---|---|
| B137953 | CHEMBL437926 | Small molecule | TETRADIFON | 356.06 | C12H6Cl4O2S | NEUTRAL | Details |
| B137991 | CHEMBL44 | Small molecule | GENISTEIN | 270.24 | C15H10O5 | NEUTRAL | Details |
| B138002 | CHEMBL440287 | Small molecule | -- | 147.09 | C2H5N5O3 | NEUTRAL | Details |
| B138009 | CHEMBL44072 | Small molecule | ENDRIN | 380.91 | C12H8Cl6O | NEUTRAL | Details |
| B138011 | CHEMBL44078 | Small molecule | -- | 337.83 | C15H16ClN3O2S | ACID | Details |
| B138016 | CHEMBL441282 | Small molecule | PROPYLPYRAZOLETRIOL | 386.45 | C24H22N2O3 | NEUTRAL | Details |
| B138053 | CHEMBL443218 | Small molecule | -- | 607.63 | C33H32F3N3O5 | ACID | Details |
| B138055 | CHEMBL443243 | Small molecule | -- | 591.75 | C38H41NO5 | ACID | Details |
| B138083 | CHEMBL4435919 | -- | -- | 266.34 | C15H22O4 | NEUTRAL | Details |
| B138095 | CHEMBL4436335 | -- | -- | 458.35 | C23H24BrNO4 | ACID | Details |
| B138101 | CHEMBL4436626 | -- | -- | 444.57 | C26H36O6 | NEUTRAL | Details |
| B138108 | CHEMBL4436761 | -- | -- | 393.32 | C18H14F3N3O4 | ACID | Details |
| B138111 | CHEMBL4436948 | -- | -- | 373.41 | C19H16FNO4S | ACID | Details |
| B138114 | CHEMBL4437146 | -- | -- | 691.66 | C34H25F4N5O5S | ACID | Details |
| B138126 | CHEMBL4437844 | -- | -- | 252.35 | C15H24O3 | NEUTRAL | Details |
| B138132 | CHEMBL4438226 | -- | -- | 472.46 | C25H23F3N2O4 | ACID | Details |
| B138152 | CHEMBL4439052 | -- | -- | 303.39 | C15H17N3O2S | ACID | Details |
| B138164 | CHEMBL443949 | Small molecule | -- | 152.24 | C10H16O | NEUTRAL | Details |
| B138169 | CHEMBL4439891 | -- | -- | 321.76 | C15H16ClN3O3 | ACID | Details |
| B138200 | CHEMBL4441247 | -- | -- | 505.66 | C31H39NO5 | NEUTRAL | Details |
| B138203 | CHEMBL4441323 | -- | -- | 295.75 | C12H10ClN3O2S | ACID | Details |
| B138211 | CHEMBL444175 | Small molecule | -- | 575.71 | C37H37NO5 | ACID | Details |
| B138217 | CHEMBL4441830 | -- | -- | 670.64 | C32H26F4N4O6S | ACID | Details |
| B138244 | CHEMBL4443192 | -- | -- | 482.59 | C23H25F3N2O2S2 | ACID | Details |
| B138247 | CHEMBL4443400 | -- | -- | 358.25 | C14H13Cl2N3O2S | ACID | Details |
| B138256 | CHEMBL4443720 | -- | -- | 615.65 | C35H32F3N3O4 | ACID | Details |
| B138266 | CHEMBL4444322 | -- | -- | 449.46 | C24H23N3O6 | ACID | Details |
| B138273 | CHEMBL4444610 | -- | -- | 483.45 | C25H20F3N3O4 | ACID | Details |
| B138280 | CHEMBL4445012 | -- | -- | 540.73 | C27H28N2O4S3 | ACID | Details |
| B138282 | CHEMBL4445084 | -- | -- | 533.52 | C21H22Cl2N2O4S3 | ACID | Details |
| B138289 | CHEMBL4445468 | -- | -- | 387.44 | C23H21N3O3 | NEUTRAL | Details |
| B138290 | CHEMBL4445519 | -- | -- | 423.45 | C21H18F3NO3S | ACID | Details |
| B138291 | CHEMBL4445524 | -- | -- | 376.24 | C19H15Cl2NO3 | ACID | Details |
| B138296 | CHEMBL4445737 | -- | -- | 472.46 | C25H23F3N2O4 | ACID | Details |
| B138301 | CHEMBL4446031 | -- | -- | 483.49 | C22H24Cl2N2O2S2 | ACID | Details |
| B138311 | CHEMBL4446633 | -- | -- | 429.48 | C25H23N3O4 | NEUTRAL | Details |
| B138315 | CHEMBL4446679 | -- | -- | 484.69 | C26H32N2O3S2 | ACID | Details |
| B138333 | CHEMBL4447577 | -- | -- | 602.61 | C33H29F3N4O4 | ACID | Details |
| B138348 | CHEMBL444825 | Small molecule | QUIZALOFOP ETHYL ESTER | 372.81 | C19H17ClN2O4 | NEUTRAL | Details |
| B138372 | CHEMBL4449183 | -- | -- | 607.73 | C37H38FN3O4 | ACID | Details |
| B138382 | CHEMBL4449687 | -- | -- | 619.62 | C34H29F4N3O4 | ACID | Details |
| B138384 | CHEMBL4449760 | -- | -- | 404.47 | C24H24N2O4 | ACID | Details |
| B138393 | CHEMBL4450146 | -- | -- | 637.61 | C34H28F5N3O4 | ACID | Details |
| B138422 | CHEMBL4451462 | -- | -- | 619.62 | C34H29F4N3O4 | ACID | Details |
| B138450 | CHEMBL4452945 | -- | -- | 669.62 | C35H29F6N3O4 | ACID | Details |
| B138457 | CHEMBL4453254 | -- | -- | 280.32 | C18H16O3 | NEUTRAL | Details |
| B138464 | CHEMBL4453610 | -- | -- | 483.36 | C24H23BrN2O4 | ACID | Details |
| B138473 | CHEMBL4454057 | -- | -- | 264.32 | C15H20O4 | NEUTRAL | Details |
| B138475 | CHEMBL4454087 | -- | -- | 445.48 | C25H23N3O5 | NEUTRAL | Details |
| B138489 | CHEMBL4454550 | -- | -- | 369.37 | C21H17F2NO3 | ACID | Details |
| B138493 | CHEMBL4454699 | -- | -- | 357.34 | C19H16FNO5 | ACID | Details |
| B138497 | CHEMBL4454999 | -- | -- | 329.79 | C17H16ClN3O2 | ACID | Details |
| B138539 | CHEMBL4456821 | -- | -- | 606.58 | C32H26F4N4O4 | ACID | Details |
| B138542 | CHEMBL4456869 | -- | -- | 391.4 | C19H15F2NO4S | ACID | Details |
| B138550 | CHEMBL4457107 | -- | -- | 359.38 | C18H14FNO4S | ACID | Details |
| B138556 | CHEMBL4457493 | -- | -- | 661.64 | C33H23F4N5O4S | NEUTRAL | Details |
| B138559 | CHEMBL4457564 | -- | -- | 669.62 | C35H29F6N3O4 | ACID | Details |
| B138575 | CHEMBL4458208 | -- | -- | 370.26 | C15H13Cl2N3O2S | ACID | Details |
| B138592 | CHEMBL445921 | Small molecule | -- | 555.55 | C30H28F3NO6 | ACID | Details |
| B138606 | CHEMBL4459695 | -- | -- | 236.35 | C15H24O2 | NEUTRAL | Details |
| B138607 | CHEMBL4459701 | -- | -- | 368.26 | C14H14BrN3O2S | ACID | Details |
| B138612 | CHEMBL4460072 | -- | -- | 400.56 | C25H36O4 | NEUTRAL | Details |
| B138616 | CHEMBL4460166 | -- | -- | 470.7 | C26H34N2O2S2 | ACID | Details |
| B138639 | CHEMBL4461490 | -- | -- | 429.48 | C25H23N3O4 | ACID | Details |
| B138646 | CHEMBL4461789 | -- | -- | 390.96 | C19H19ClN2OS2 | NEUTRAL | Details |
| B138647 | CHEMBL44618 | Small molecule | CHLOROFORM | 119.38 | CHCl3 | None | Details |
| B138649 | CHEMBL4461949 | -- | -- | 438.91 | C24H23ClN2O4 | ACID | Details |
| B138652 | CHEMBL4462202 | -- | -- | 453.03 | C24H21ClN2OS2 | NEUTRAL | Details |
| B138659 | CHEMBL4462429 | -- | -- | 356.4 | C18H16N2O4S | ACID | Details |
| B138671 | CHEMBL4463216 | -- | -- | 359.38 | C18H14FNO4S | ACID | Details |
| B138691 | CHEMBL4463798 | -- | -- | 391.4 | C19H15F2NO4S | ACID | Details |
| B138703 | CHEMBL4464538 | -- | -- | 490.69 | C28H30N2O2S2 | ACID | Details |
| B138707 | CHEMBL446489 | Small molecule | -- | 549.67 | C35H35NO5 | ACID | Details |
| B138708 | CHEMBL4465004 | -- | -- | 365.89 | C17H20ClN3O2S | ACID | Details |
| B138711 | CHEMBL4465154 | -- | -- | 373.41 | C19H16FNO4S | ACID | Details |
| B138747 | CHEMBL4466509 | -- | -- | 264.32 | C15H20O4 | NEUTRAL | Details |
| B138749 | CHEMBL4466552 | -- | -- | 502.6 | C28H38O8 | NEUTRAL | Details |
| B138755 | CHEMBL4466709 | -- | -- | 533.52 | C21H22Cl2N2O4S3 | ACID | Details |
| B138762 | CHEMBL4466987 | -- | -- | 369.37 | C21H17F2NO3 | ACID | Details |
| B138765 | CHEMBL4467078 | -- | -- | 587.64 | C31H36F3N3O5 | ACID | Details |
| B138770 | CHEMBL4467339 | -- | -- | 534.65 | C32H38O7 | NEUTRAL | Details |
| B138775 | CHEMBL4467778 | -- | -- | 246.31 | C15H18O3 | NEUTRAL | Details |
| B138785 | CHEMBL4468381 | -- | -- | 468.0 | C23H18ClN3O2S2 | NEUTRAL | Details |
| B138794 | CHEMBL446893 | Small molecule | -- | 350.41 | C22H22O4 | ACID | Details |
| B138814 | CHEMBL4470507 | -- | -- | 281.4 | C16H27NO3 | ACID | Details |
| B138818 | CHEMBL4470753 | -- | -- | 444.33 | C22H22BrNO4 | ACID | Details |
| B138828 | CHEMBL4471255 | -- | -- | 309.78 | C13H12ClN3O2S | ACID | Details |
| B138834 | CHEMBL4471421 | -- | -- | 533.52 | C21H22Cl2N2O4S3 | ACID | Details |
| B138837 | CHEMBL4471562 | -- | -- | 602.61 | C33H29F3N4O4 | ACID | Details |
| B138846 | CHEMBL4471853 | -- | -- | 438.91 | C24H23ClN2O4 | ACID | Details |
| B138848 | CHEMBL447190 | Small molecule | -- | 446.97 | C25H31ClO5 | ACID | Details |
| B138863 | CHEMBL4472821 | -- | -- | 372.42 | C19H17FN2O3S | ACID | Details |
| B138879 | CHEMBL4473666 | -- | -- | 620.6 | C33H28F4N4O4 | NEUTRAL | Details |
| B138883 | CHEMBL4473917 | -- | -- | 308.37 | C17H24O5 | NEUTRAL | Details |
| B138890 | CHEMBL4474275 | -- | -- | 631.65 | C35H32F3N3O5 | ACID | Details |
| B138892 | CHEMBL4474407 | -- | -- | 499.08 | C21H23ClN2O4S3 | ACID | Details |
| B138906 | CHEMBL4475061 | -- | -- | 443.5 | C26H25N3O4 | NEUTRAL | Details |
| B138910 | CHEMBL447533 | Small molecule | -- | 373.45 | C21H27NO5 | ACID | Details |
| B138917 | CHEMBL4475797 | -- | -- | 503.57 | C29H30FN3O4 | ACID | Details |
| B138926 | CHEMBL4476449 | -- | -- | 362.27 | C17H12F6O2 | ACID | Details |