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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A known ✓ | Q03164 | 1/20 | 0.41 |
| ▸ | CHRM3 known ✓ | P20309 | 5/20 | 0.40 |
| ▸ | CHRM2 known ✓ | P08172 | 4/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | LSS | P48449 | 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 | |
|---|---|---|---|---|
| SCHEMBL3088178 | 0.92 | CHRNA7 (0.46) | CHRNA7BCHEACHECHRM3CHRM2 | |
| SCHEMBL1018721 | 0.92 | CHRNA7 (0.46) | CHRNA7BCHEACHECHRM3CHRM2 | |
| SCHEMBL3084805 | 0.92 | CHRNA7 (0.46) | CHRNA7BCHEACHECHRM3CHRM2 | |
| Fumaric Acid SCHEMBL1018818 | 0.88 | CHRM2 (0.38) | CHRNA7BCHEACHEMAPTMEN1 | |
| Fumaric Acid SCHEMBL1020193 | 0.82 | LSS (0.53) | CHRNA7BCHEACHEMAPTMEN1 | |
| SCHEMBL1019629 | 0.82 | CHRNA7 (0.45) | CHRNA7CHRM3CHRM2CHRM1CHRM4 | |
| SCHEMBL1017423 | 0.81 | RAB9A (0.44) | CHRNA7BCHEACHEMEN1KMT2A | |
| SCHEMBL3088580 | 0.81 | RAB9A (0.44) | CHRNA7BCHEACHEMEN1KMT2A | |
| SCHEMBL3080514 | 0.81 | RAB9A (0.44) | CHRNA7BCHEACHEMEN1KMT2A | |
| SCHEMBL3080565 | 0.81 | CHRNA7 (0.44) | CHRNA7CHRM3CHRM2CHRM1CHRM4 |
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-1802616-B1 | NOVEL AZABICYCLIC ARYL DERIVATIVES AND THEIR MEDICAL USE | NEUROSEARCH AS (DK) | 2011-01-12 | — | — | EP | disclosed |