Known targets — ChEMBL curated mechanism
ADRB1ADRB2ATP4AATP4BAXLCHRM2CHRM3DRD2FLT3HRH1HTR2AHTR2BHTR2CKCNH2KMT2AMAP2K1MAP2K2MEN1MLNRPLK4RENS1PR1SLC6A2SLC6A4atpAatpBatpCatpDatpEatpFatpFHatpGpol
The experimentally established mechanism targets of Fumaric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 known ✓ | P14416 | 4/20 | 0.42 |
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A known ✓ | Q03164 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 5/20 | 0.42 |
| ▸ | HTR3E | A5X5Y0 | 3/20 | 0.42 |
| ▸ | HTR3B | O95264 | 3/20 | 0.42 |
| ▸ | HTR3D | Q70Z44 | 3/20 | 0.42 |
| ▸ | HTR3C | Q8WXA8 | 3/20 | 0.42 |
| ▸ | DRD4 | P21917 | 2/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.42 |
| ▸ | HTR5A | P47898 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL9622764 | 1.00 | CYP3A4 (0.46) | CYP3A4MAPK1HTR3ADRD2HTR3E | |
| SCHEMBL9623046 | 0.94 | HTR3A (0.47) | MAPK1HTR3ADRD2HTR3EHTR3B | |
| SCHEMBL9622424 | 0.85 | HTR3A (0.58) | MAPK1HTR3ADRD2HTR3EHTR3B | |
| SCHEMBL9623235 | 0.84 | DRD2 (0.45) | MAPK1HTR3ADRD2HTR3EHTR3B | |
| SCHEMBL9622705 | 0.84 | DRD2 (0.44) | MAPK1HTR3ADRD2HTR3EHTR3B | |
| SCHEMBL9623137 | 0.83 | DRD2 (0.44) | MAPK1HTR3ADRD2HTR3EHTR3B | |
| SCHEMBL9622432 | 0.80 | DRD2 (0.49) | HTR3ADRD2HTR3EHTR3BHTR3D | |
| SCHEMBL9458047 | 0.77 | HTR3E (0.52) | HTR3ADRD2HTR3EHTR3BHTR3D | |
| SCHEMBL9622821 | 0.77 | HTR4 (0.40) | MAPK1HTR3ADRD2HTR3EHTR3B | |
| Fumaric Acid SCHEMBL9623206 | 0.77 | DRD4 (0.44) | CYP3A4HTR3ADRD2DRD4DRD3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5137895-A | Antiemetic, anxiolytic, gastric emptying and serotonin modulating activity | A. H. ROBINS COMPANY, INCORPORATED (US) | 1992-08-11 | — | — | US | disclosed |