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 | |
|---|---|---|---|---|
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.47 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.47 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.47 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | NAMPT | P43490 | 3/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | CA3 | P07451 | 1/20 | 0.44 |
| ▸ | CA4 | P22748 | 1/20 | 0.44 |
| ▸ | CA6 | P23280 | 1/20 | 0.44 |
| ▸ | CA5A | P35218 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL393736 | 0.86 | CA2 (0.63) | NAPRTCA2CA12CA1CA9 | |
| SCHEMBL29614165 | 0.86 | CA2 (0.63) | NAPRTCA2CA12CA1CA9 | |
| Formic Acid SCHEMBL29730851 | 0.84 | NAPRT (0.58) | NAPRTCA2CA12CA1CA9 | |
| SCHEMBL17476040 | 0.84 | CA2 (0.61) | NAPRTCA2CA12CA1CA9 | |
| Hydrochloric Acid SCHEMBL29968745 | 0.84 | CA2 (0.61) | NAPRTCA2CA12CA1CA9 | |
| Fluoride SCHEMBL28328135 | 0.84 | CA2 (0.61) | NAPRTCA2CA12CA1CA9 | |
| Hydrochloric Acid SCHEMBL1774480 | 0.84 | CA2 (0.61) | NAPRTCA2CA12CA1CA9 | |
| Hydrochloric Acid SCHEMBL28262884 | 0.84 | CA2 (0.61) | NAPRTCA2CA12CA1CA9 | |
| Potassium SCHEMBL17476041 | 0.84 | CA2 (0.61) | NAPRTCA2CA12CA1CA9 | |
| Trifluoroacetic Acid SCHEMBL29969023 | 0.82 | NAPRT (0.51) | NAPRTCA2KDM4ECA12CA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1642938-A | Novel compounds | ASTRAZENECA AB (SE) | 2005-07-20 | — | — | CN | disclosed |