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 | |
|---|---|---|---|---|
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A known ✓ | Q03164 | 1/20 | 0.42 |
| ▸ | ACSL1 | P33121 | 2/20 | 0.46 |
| ▸ | ACSL3 | O95573 | 1/20 | 0.46 |
| ▸ | ACSL6 | Q9UKU0 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | LSS | P48449 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL905368 | 0.90 | LSS (0.44) | ACSL1ACSL3ACSL6LMNALSS | |
| SCHEMBL1794239 | 0.83 | ACSL1 (0.56) | ACSL1ACSL3ACSL6CHRNA7 | |
| SCHEMBL1794127 | 0.83 | ACSL1 (0.56) | ACSL1ACSL3ACSL6CHRNA7 | |
| SCHEMBL1794125 | 0.83 | ACSL1 (0.56) | ACSL1ACSL3ACSL6CHRNA7 | |
| Trifluoroacetic Acid SCHEMBL1794473 | 0.82 | ACSL1 (0.55) | ACSL1ACSL3ACSL6CHRNA7 | |
| Trifluoroacetic Acid SCHEMBL1796405 | 0.82 | ACSL1 (0.55) | ACSL1ACSL3ACSL6CHRNA7 | |
| Fumaric Acid SCHEMBL1020193 | 0.78 | LSS (0.53) | LMNALSSCHRNA7BCHEACHE | |
| Fumaric Acid SCHEMBL1798517 | 0.77 | LSS (0.46) | LSSCHRNA7BCHEACHE | |
| Fumaric Acid SCHEMBL1798513 | 0.77 | LSS (0.46) | LSSCHRNA7BCHEACHE | |
| Fumaric Acid SCHEMBL1796669 | 0.77 | LSS (0.49) | LSSCHRNA7BCHEACHEMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1656375-B1 | NOVEL QUINUCLIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE | NEUROSEARCH AS (DK) | 2011-01-19 | — | — | EP | disclosed |