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 | |
|---|---|---|---|---|
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A known ✓ | Q03164 | 1/20 | 0.38 |
| ▸ | HTR2A known ✓ | P28223 | 4/20 | 0.36 |
| ▸ | HTR2C known ✓ | P28335 | 4/20 | 0.36 |
| ▸ | DRD2 known ✓ | P14416 | 3/20 | 0.36 |
| ▸ | HRH1 known ✓ | P35367 | 3/20 | 0.36 |
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.36 |
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.36 |
| ▸ | HTR2B known ✓ | P41595 | 1/20 | 0.36 |
| ▸ | KCNH2 known ✓ | Q12809 | 1/20 | 0.36 |
| ▸ | HRH2 | P25021 | 1/20 | 0.52 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.43 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.36 |
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 SCHEMBL11251972 | 1.00 | HRH2 (0.52) | HRH2ALOX5HRH4LMNAMAPT | |
| Fumaric Acid SCHEMBL11263353 | 0.91 | HRH2 (0.52) | HRH2ALOX5HRH4LMNAMAPT | |
| Fumaric Acid SCHEMBL11101572 | 0.91 | HRH2 (0.52) | HRH2ALOX5HRH4LMNAMAPT | |
| Fumaric Acid SCHEMBL11261244 | 0.89 | HRH2 (0.49) | HRH2ALOX5HRH4LMNAMAPT | |
| Fumaric Acid SCHEMBL11261237 | 0.89 | HRH2 (0.49) | HRH2ALOX5HRH4LMNAMAPT | |
| SCHEMBL11098945 | 0.80 | HTR2A (0.43) | HRH2LMNAMAPTMEN1KMT2A | |
| Fumaric Acid SCHEMBL11243485 | 0.78 | MAPT (0.49) | HRH2LMNAMAPTMEN1KMT2A | |
| SCHEMBL11098676 | 0.77 | HTR2A (0.40) | HRH2LMNAMAPTMEN1KMT2A | |
| SCHEMBL11101229 | 0.75 | LMNA (0.54) | ALOX5LMNAMAPTMEN1KMT2A | |
| Fumaric Acid SCHEMBL11248605 | 0.73 | HTR2A (0.45) | HRH2LMNAMAPTMEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0035749-B1 | HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | C.H. BOEHRINGER SOHN (DE) | 1984-06-06 | — | — | EP | disclosed |
| 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 |