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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 1/20 | 0.49 |
| ▸ | CXCR4 | P61073 | 3/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.30 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.30 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.30 |
| ▸ | PTGFR | P43088 | 1/20 | 0.30 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.30 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.30 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.30 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL8093570 | 1.00 | ADRA2A (0.49) | ADRA2ACXCR4HCAR2ALDH1A1TAAR1 | |
| SCHEMBL6950882 | 0.90 | ADRA2A (0.58) | ADRA2ACYP1A2CYP2D6CYP2C19 | |
| Fumaric Acid SCHEMBL8084690 | 0.84 | TBXA2R (0.43) | CXCR4TBXA2RPTGER4PTGFRPTGER3 | |
| Fumaric Acid SCHEMBL8084695 | 0.84 | TBXA2R (0.43) | CXCR4TBXA2RPTGER4PTGFRPTGER3 | |
| Fumaric Acid SCHEMBL8093561 | 0.77 | CCR3 (0.37) | HCAR2ALDH1A1CYP2D6CYP2C19 | |
| Fumaric Acid SCHEMBL8093552 | 0.77 | CCR3 (0.37) | HCAR2ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL8093566 | 0.74 | ADRA2A (0.46) | ADRA2A | |
| SCHEMBL6954690 | 0.72 | SLC6A2 (0.41) | ADRA2ATAAR1CYP1A2CYP2D6CYP2C19 | |
| Fumaric Acid SCHEMBL8092413 | 0.72 | ADRA2A (0.50) | ADRA2A | |
| Fumaric Acid SCHEMBL8092419 | 0.72 | ADRA2A (0.50) | ADRA2A |
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-6127396-A | Imidazoline compounds | ADIR ET COMPAGNIE (FR) | 2000-10-03 | — | — | US | disclosed |