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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C known ✓ | P28335 | 3/20 | 0.57 |
| ▸ | HTR2A known ✓ | P28223 | 2/20 | 0.57 |
| ▸ | HTR1A | P08908 | 17/20 | 0.71 |
| ▸ | HTR1D | P28221 | 17/20 | 0.71 |
| ▸ | HTR1B | P28222 | 17/20 | 0.71 |
| ▸ | MAPT | P10636 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | HTR6 | P50406 | 3/20 | 0.57 |
| ▸ | HTR7 | P34969 | 2/20 | 0.57 |
| ▸ | STS | P08842 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL8759945 | 0.95 | HTR1A (0.68) | HTR1AHTR1DHTR1BMAPTALDH1A1 | |
| Fumaric Acid SCHEMBL8692233 | 0.90 | HTR1A (0.86) | HTR1AHTR1DHTR1BMAPTALDH1A1 | |
| SCHEMBL8691191 | 0.88 | HTR1A (0.68) | HTR1AHTR1DHTR1BMAPTALDH1A1 | |
| SCHEMBL8691219 | 0.84 | HTR1A (0.85) | HTR1AHTR1DHTR1BMAPTALDH1A1 | |
| SCHEMBL8696773 | 0.83 | HTR1A (0.69) | HTR1AHTR1DHTR1BMAPTALDH1A1 | |
| Fumaric Acid SCHEMBL8694602 | 0.82 | HTR1A (1.00) | HTR1AHTR1DHTR1BHTR2CHTR6 | |
| SCHEMBL8693877 | 0.81 | HTR1A (0.67) | HTR1AHTR1DHTR1BMAPTALDH1A1 | |
| Fumaric Acid SCHEMBL8691626 | 0.80 | HTR1A (1.00) | HTR1AHTR1DHTR1BHTR2CHTR6 | |
| Fumaric Acid SCHEMBL8692493 | 0.78 | HTR1A (1.00) | HTR1AHTR1DHTR1BHTR2CHTR6 | |
| Fumaric Acid SCHEMBL8692040 | 0.77 | HTR1A (0.83) | HTR1AHTR1DHTR1BHTR2CHTR6 |
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-5789412-A | 5-HYDROXYTRYPTAMINE (SEROTONIN) RECEPTOR ANTAGONISTS FOR THE CURATIVE OR PREVENTIVE TREATMENT OF PAIN, DEPRESSION, OBSESSIVE COMPULSIVE DISORDERS, ANXIETY OR PANIC ATTACK, OR CANCER | PIERRE FABRE MEDICAMENT (FR) | 1998-08-04 | — | — | US | disclosed |