Known targets — ChEMBL curated mechanism
ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ATP4AATP4BAXLBTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CHRM2CHRM3CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4FLT3HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3KCNH2KMT2AMAP2K1MAP2K2MEN1MLNRMPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PLK4PPARGRENS1PR1SLC6A2SLC6A3SLC6A4SMOTYK2atpAatpBatpCatpDatpEatpFatpFHatpGpol
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 | |
|---|---|---|---|---|
| ▸ | MTOR known ✓ | P42345 | 1/20 | 0.39 |
| ▸ | HRH3 known ✓ | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A known ✓ | Q03164 | 1/20 | 0.39 |
| ▸ | ESRRG | P62508 | 4/20 | 0.44 |
| ▸ | ESR1 | P03372 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL9657260 | 1.00 | ESRRG (0.44) | ESRRGESR1ALDH1A1LMNAGAA | |
| Fumaric Acid SCHEMBL9617889 | 0.87 | ESRRG (0.49) | ESRRGESR1ALDH1A1HRH3MAPT | |
| Fumaric Acid SCHEMBL9617890 | 0.87 | ESRRG (0.49) | ESRRGESR1ALDH1A1HRH3MAPT | |
| Fumaric Acid SCHEMBL9656796 | 0.86 | ESRRG (0.47) | ESRRGESR1ALDH1A1HRH3MAPT | |
| Fumaric Acid SCHEMBL9656789 | 0.86 | ESRRG (0.47) | ESRRGESR1ALDH1A1HRH3MAPT | |
| Hydrochloric Acid SCHEMBL9656694 | 0.85 | ESRRG (0.47) | ESRRGESR1ALDH1A1LMNAKDM4E | |
| Hydrochloric Acid SCHEMBL9656762 | 0.84 | ESRRG (0.45) | ESRRGESR1ALDH1A1LMNAKDM4E | |
| SCHEMBL3438604 | 0.74 | ESRRG (0.54) | ESRRGESR1ALDH1A1RAB9AHRH3 | |
| Hydrochloric Acid SCHEMBL9655021 | 0.71 | ESRRG (0.53) | ESRRGESR1ALDH1A1RAB9AHRH3 | |
| SCHEMBL9615614 | 0.69 | CYP3A4 (0.54) | ALDH1A1LMNAKDM4ETSHRMTOR |
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-0472304-A2 | Pharmaceutical compositions containing therapeutically active organosilane derivatives and process for preparing same | Richter Gedeon Vegyészeti Gyár R.T. (HU) | 1992-02-26 | — | — | EP | disclosed |