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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 5/20 | 0.46 |
| ▸ | SLC6A4 known ✓ | P31645 | 5/20 | 0.46 |
| ▸ | SLC6A3 known ✓ | Q01959 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | GFER | P55789 | 1/20 | 0.51 |
| ▸ | SLC6A9 | P48067 | 5/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Maleic Acid SCHEMBL8587758 | 1.00 | GAA (0.51) | GAAGFERSLC6A9SMN1; SMN2SLC6A2 | |
| Maleic Acid SCHEMBL8530058 | 0.92 | GAA (0.47) | GAAGFERSLC6A9SMN1; SMN2SLC6A2 | |
| Fumaric Acid SCHEMBL8530062 | 0.92 | GAA (0.47) | GAAGFERSLC6A9SMN1; SMN2SLC6A2 | |
| Maleic Acid SCHEMBL8529729 | 0.89 | AGBL2 (0.52) | GAAGFERSLC6A2SLC6A4SLC6A3 | |
| Fumaric Acid SCHEMBL8529731 | 0.89 | AGBL2 (0.52) | GAAGFERSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8531351 | 0.79 | SLC6A2 (0.53) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8534966 | 0.79 | SLC6A4 (0.56) | SLC6A9SMN1; SMN2SLC6A2SLC6A4SLC6A3 | |
| Maleic Acid SCHEMBL29711085 | 0.78 | SMN1; SMN2 (0.71) | GAAGFERSMN1; SMN2SLC6A2SLC6A4 | |
| Fumaric Acid SCHEMBL8530353 | 0.78 | GAA (0.60) | GAAGFERSMN1; SMN2SLC6A2SLC6A4 | |
| Maleic Acid SCHEMBL8530351 | 0.78 | GAA (0.60) | GAAGFERSMN1; SMN2SLC6A2SLC6A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0859757-A1 | DERIVATES OF N,N-DIMETHYL-2-(ARYLTHIO)BENZYLAMINE, THEIR SALTS, METHODS OF PREPARATION AND THEIR USE IN PHARMACEUTICAL MEDICAMENTS | Farmak A.S. (CZ) | 1998-08-26 | — | — | EP | disclosed |
| WO-1997017325-A1 | DERIVATES OF N,N-DIMETHYL-2-(ARYLTHIO)BENZYLAMINE, THEIR SALTS, METHODS OF PREPARATION AND THEIR USE IN PHARMACEUTICAL MEDICAMENTS | FARMAK A.S. (CZ) | 1997-05-15 | — | — | WO | disclosed |