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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 known ✓ | P21453 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.30 |
| ▸ | PDE5A | O76074 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9501638 | 0.92 | PTGS2 (0.31) | — | |
| Fumaric Acid SCHEMBL9795052 | 0.79 | MEN1 (0.36) | S1PR1S1PR3PDE5A | |
| Fumaric Acid SCHEMBL9795259 | 0.76 | PDE5A (0.37) | ALDH1A1S1PR1S1PR3PDE5A | |
| Fumaric Acid SCHEMBL9795210 | 0.73 | ALDH1A1 (0.34) | ALDH1A1 | |
| SCHEMBL4593304 | 0.70 | PTGS2 (0.33) | ALDH1A1 | |
| Fumaric Acid SCHEMBL9795119 | 0.70 | PDE5A (0.32) | PDE5A | |
| SCHEMBL9497759 | 0.70 | POLB (0.34) | ALDH1A1GAA | |
| Fumaric Acid SCHEMBL9795074 | 0.69 | MEN1 (0.36) | ALDH1A1GAAPDE5A | |
| SCHEMBL9497848 | 0.68 | MEN1 (0.40) | ALDH1A1 | |
| SCHEMBL9497710 | 0.67 | KDM4E (0.30) | — |
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-5037849-A | For treatment of heart and circulatory diseases | BOEHRINGER MANNHEIM GMBH (DE) | 1991-08-06 | — | — | US | disclosed |