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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 11/20 | 0.42 |
| ▸ | SLC6A4 known ✓ | P31645 | 10/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.42 |
| ▸ | HTR1F | P30939 | 2/20 | 0.42 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.40 |
| ▸ | OXTR | P30559 | 1/20 | 0.40 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.40 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5983518 | 0.94 | SLC6A4 (0.46) | MAPTSLC6A2SLC6A3SLC6A4HTR1F | |
| Hydrochloric Acid SCHEMBL5983492 | 0.84 | ALDH1A1 (0.43) | MAPTHTR1FAVPR2 | |
| SCHEMBL12020918 | 0.82 | HTR1F (0.55) | MAPTHTR1FACKR3HPGDAVPR2 | |
| Hydrochloric Acid SCHEMBL5983763 | 0.82 | KCNK3 (0.49) | MAPTSLC6A2SLC6A3SLC6A4 | |
| Hydrochloric Acid SCHEMBL1197873 | 0.81 | HTR1F (0.54) | MAPTHTR1FACKR3HPGDAVPR2 | |
| Hydrochloric Acid SCHEMBL5984031 | 0.81 | PTGS1 (0.43) | SLC6A2SLC6A3SLC6A4 | |
| Hydrochloric Acid SCHEMBL5990368 | 0.80 | SLC6A2 (0.44) | MAPTSLC6A2SLC6A3SLC6A4HTR1F | |
| Hydrochloric Acid SCHEMBL5984112 | 0.79 | HTR1F (0.47) | MAPTSLC6A2SLC6A3SLC6A4HTR1F | |
| Hydrochloric Acid SCHEMBL5982835 | 0.79 | MEN1 (0.53) | MAPTHTR1FACKR3HPGD | |
| SCHEMBL12020846 | 0.79 | ACKR3 (0.50) | HTR1FACKR3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1663971-A1 | SUBSTITUTED 2-CARBONYLAMINO-6-PIPERIDINAMINOPYRIDINES AND SUBSTITUTED 1-CARBONYLAMINO-3-PIPERIDINAMINOBENZENES AS 5-HT1F AGONISTS | Eli Lilly and Company (US) | 2006-06-07 | — | — | EP | disclosed |
| WO-2005035499-A1 | SUBSTITUTED 2-CARBONYLAMINO-6-PIPERIDINAMINOPYRIDINES AND SUBSTITUTED 1-CARBONYLAMINO-3-PIPERIDINAMINOBENZENES AS 5-HT1F AGONISTS | ELI LILLY AND COMPANY (US) | 2005-04-21 | — | — | WO | disclosed |