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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A known ✓ | P28223 | 2/20 | 0.49 |
| ▸ | DRD2 known ✓ | P14416 | 2/20 | 0.47 |
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.47 |
| ▸ | CCR3 | P51677 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | HTR7 | P34969 | 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 | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL10718869 | 1.00 | HTR2A (0.49) | HTR2ADRD2CHRM2HTR1ACHRM1 | |
| Fumaric Acid SCHEMBL10718456 | 0.94 | HTR2A (0.46) | HTR2ADRD2CHRM2HTR1ACHRM1 | |
| SCHEMBL10722004 | 0.93 | HTR2A (0.53) | HTR2ADRD2HTR1ACCR3CYP2D6 | |
| SCHEMBL10719794 | 0.86 | MEN1 (0.51) | HTR2ADRD2HTR1ACCR3HTR7 | |
| Fumaric Acid SCHEMBL10719500 | 0.85 | ALDH1A1 (0.53) | HTR2ADRD2CYP2D6 | |
| Maleic Acid SCHEMBL10719497 | 0.85 | ALDH1A1 (0.53) | HTR2ADRD2CYP2D6 | |
| Fumaric Acid SCHEMBL10722445 | 0.82 | CCR3 (0.52) | HTR2ADRD2CHRM2HTR1ACHRM1 | |
| Maleic Acid SCHEMBL10722434 | 0.82 | CCR3 (0.52) | HTR2ADRD2CHRM2HTR1ACHRM1 | |
| Fumaric Acid SCHEMBL10461367 | 0.81 | DRD2 (0.51) | HTR2ADRD2CHRM2HTR1ACHRM1 | |
| Fumaric Acid SCHEMBL10461365 | 0.81 | DRD2 (0.51) | HTR2ADRD2CHRM2HTR1ACHRM1 |
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-0235463-A2 | N-substituted-arylalkyl and arylalkylene piperidines as cardiovascular antihistaminic and antisecretory agents | A.H. ROBINS COMPANY, INCORPORATED (a Delaware corporation) (US) | 1987-09-09 | — | — | EP | disclosed |