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 | 2/20 | 0.42 |
| ▸ | KMT2A known ✓ | Q03164 | 2/20 | 0.42 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.44 |
| ▸ | HPGD | P15428 | 6/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1689092 | 0.91 | CHRNA7 (0.59) | CHRNA7ALDH1A1KDM4EHPGDL3MBTL1 | |
| Fumaric Acid SCHEMBL2112124 | 0.90 | CHRNA7 (0.55) | CHRNA7ALDH1A1KDM4EHPGDHTT | |
| Fumaric Acid SCHEMBL5218174 | 0.81 | CHRNA7 (0.65) | CHRNA7BCHEACHEBACE1MAPK1 | |
| SCHEMBL1689258 | 0.80 | CHRNA7 (0.66) | CHRNA7ALDH1A1KDM4EHPGDHSD17B10 | |
| Fumaric Acid SCHEMBL2113241 | 0.79 | CHRNA7 (0.65) | CHRNA7CHRNB4CHRNA3 | |
| Fumaric Acid SCHEMBL2111723 | 0.79 | CHRNA7 (0.64) | CHRNA7ALDH1A1KDM4EHPGDHSD17B10 | |
| Fumaric Acid SCHEMBL2113268 | 0.78 | CHRNA7 (0.60) | CHRNA7ALDH1A1KDM4EHPGDHSD17B10 | |
| Fumaric Acid SCHEMBL2112312 | 0.77 | CHRNA7 (0.54) | CHRNA7ALDH1A1KDM4ESMN1; SMN2MEN1 | |
| Fumaric Acid SCHEMBL2113253 | 0.77 | CHRNA7 (0.54) | CHRNA7ALDH1A1L3MBTL1SMN1; SMN2MEN1 | |
| Fumaric Acid SCHEMBL5220969 | 0.77 | CHRNA7 (0.56) | CHRNA7ALDH1A1HPGDHSD17B10SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-8158619-B2 | 1,4-diaza-bicyclo[3.2.2]nonyl oxadiazolyl compounds and their medical use | NEUROSEARCH A/S (DK) | 2012-04-17 | — | — | US | disclosed |