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 | 0.41 |
| ▸ | KMT2A known ✓ | Q03164 | 1/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 7/20 | 0.40 |
| ▸ | RAB9A | P51151 | 7/20 | 0.40 |
| ▸ | HPGD | P15428 | 5/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1753834 | 0.90 | CHRNA7 (0.60) | CHRNA7ALDH1A1KDM4ERECQLNPC1 | |
| Fumaric Acid SCHEMBL5218174 | 0.84 | CHRNA7 (0.65) | CHRNA7NPC1RAB9ACHRNB4CHRNA3 | |
| Fumaric Acid SCHEMBL2114381 | 0.80 | CHRNA7 (0.51) | CHRNA7ALDH1A1NPC1RAB9AHPGD | |
| Fumaric Acid SCHEMBL2111723 | 0.79 | CHRNA7 (0.64) | CHRNA7ALDH1A1KDM4EMEN1KMT2A | |
| Fumaric Acid SCHEMBL1759127 | 0.78 | CHRNA7 (0.49) | CHRNA7CHRNB4CHRNA3HTR3A | |
| Fumaric Acid SCHEMBL2112064 | 0.78 | CHRNA7 (0.64) | CHRNA7ALDH1A1KDM4ECHRNB4CHRNA3 | |
| Fumaric Acid SCHEMBL2113253 | 0.78 | CHRNA7 (0.54) | CHRNA7ALDH1A1MEN1KMT2ANPC1 | |
| Fumaric Acid SCHEMBL2112312 | 0.78 | CHRNA7 (0.54) | CHRNA7ALDH1A1KDM4EMEN1KMT2A | |
| Fumaric Acid SCHEMBL5220969 | 0.78 | CHRNA7 (0.56) | CHRNA7ALDH1A1HPGDSMN1; SMN2CHRNB4 | |
| Fumaric Acid SCHEMBL2113241 | 0.77 | CHRNA7 (0.65) | CHRNA7CHRNB4CHRNA3HTR3A |
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-1785425-A2 | Novel 1,4-diazabicycloalkane derivatives, their preparation and use | NeuroSearch A/S (DK) | 2007-05-16 | — | — | EP | disclosed |