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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A known ✓ | P28223 | 6/20 | 0.45 |
| ▸ | HTR2C known ✓ | P28335 | 2/20 | 0.40 |
| ▸ | HRH1 known ✓ | P35367 | 2/20 | 0.40 |
| ▸ | MEN1 known ✓ | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A known ✓ | Q03164 | 3/20 | 0.37 |
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 5/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HRH2 | P25021 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | GMNN | O75496 | 1/20 | 0.37 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.37 |
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 SCHEMBL11248605 | 1.00 | HTR2A (0.45) | HTR2ALMNARAB9AHTR2CHRH1 | |
| SCHEMBL11106809 | 0.89 | HTR2A (0.49) | HTR2AHTR2CHRH1KMT2ASLC6A2 | |
| Fumaric Acid SCHEMBL11256018 | 0.87 | HTR2A (0.48) | HTR2ALMNAHTR2CHRH1MAPT | |
| Fumaric Acid SCHEMBL5367297 | 0.87 | HTR2A (0.48) | HTR2ALMNAHTR2CHRH1MAPT | |
| Fumaric Acid SCHEMBL29945132 | 0.87 | HTR2A (0.48) | HTR2ALMNAHTR2CHRH1MAPT | |
| Fumaric Acid SCHEMBL11261244 | 0.78 | HRH2 (0.49) | HTR2ALMNARAB9AHTR2CHRH1 | |
| Fumaric Acid SCHEMBL11261237 | 0.78 | HRH2 (0.49) | HTR2ALMNARAB9AHTR2CHRH1 | |
| Fumaric Acid SCHEMBL11101572 | 0.76 | HRH2 (0.52) | HTR2ALMNAHTR2CHRH1MAPT | |
| Fumaric Acid SCHEMBL11263353 | 0.76 | HRH2 (0.52) | HTR2ALMNAHTR2CHRH1MAPT | |
| SCHEMBL5365272 | 0.75 | HTR2A (0.59) | HTR2AHTR2CHRH1SLC6A2SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-4313931-A | ANTIHISTAMINES, ANTISEROTONINE AGENTS, ANTIALLERGENS, BRONCHODILATOR AGENTS, ANTIANAPHYLACTIC AGENTS | BOEHRINGER INGELHEIM KG (DE) | 1982-02-02 | — | — | US | disclosed |
| EP-0035749-A1 | Heterocyclic compounds, their preparation and pharmaceutical compositions containing them | C.H. BOEHRINGER SOHN (DE) | 1981-09-16 | — | — | EP | disclosed |