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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 2/20 | 0.33 |
| ▸ | SLC6A4 known ✓ | P31645 | 2/20 | 0.33 |
| ▸ | KCNH2 known ✓ | Q12809 | 1/20 | 0.33 |
| ▸ | CCR3 | P51677 | 8/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | FCER2 | P06734 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
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 SCHEMBL8093561 | 1.00 | CCR3 (0.37) | CCR3CYP2D6FCER2SLC6A2SLC6A4 | |
| SCHEMBL6957391 | 0.89 | SLC6A2 (0.39) | CCR3FCER2SLC6A2SLC6A4SLC6A3 | |
| Fumaric Acid SCHEMBL8084695 | 0.87 | TBXA2R (0.43) | CYP2D6SLC6A2SLC6A4SLC6A3KCNH2 | |
| Fumaric Acid SCHEMBL8084690 | 0.87 | TBXA2R (0.43) | CYP2D6SLC6A2SLC6A4SLC6A3KCNH2 | |
| Fumaric Acid SCHEMBL8091527 | 0.79 | HRH3 (0.35) | CCR3CYP2D6SLC6A2SLC6A4 | |
| Fumaric Acid SCHEMBL8093564 | 0.77 | ADRA2A (0.49) | CYP2D6HCAR2ALDH1A1CYP2C19 | |
| Fumaric Acid SCHEMBL8093570 | 0.77 | ADRA2A (0.49) | CYP2D6HCAR2ALDH1A1CYP2C19 | |
| SCHEMBL6954690 | 0.75 | SLC6A2 (0.41) | CYP2D6SLC6A2SLC6A4SLC6A3KCNH2 | |
| Fumaric Acid SCHEMBL8097507 | 0.74 | ADRA2A (0.50) | ALDH1A1CYP2C19 | |
| SCHEMBL8093558 | 0.72 | CYP19A1 (0.37) | CCR3SLC6A2SLC6A4SLC6A3KCNH2 |
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-6127396-A | Imidazoline compounds | ADIR ET COMPAGNIE (FR) | 2000-10-03 | — | — | US | disclosed |