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 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 19/20 | 0.83 |
| ▸ | ADRA1B | P35368 | 16/20 | 0.83 |
| ▸ | ADRA1D | P25100 | 15/20 | 0.83 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.83 |
| ▸ | ADRA2C | P18825 | 6/20 | 0.62 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.51 |
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 SCHEMBL6368473 | 1.00 | ADRA1A (0.83) | ADRA1AADRA1BADRA1DADRA2AADRA2C | |
| SCHEMBL6368293 | 0.91 | ADRA1A (1.00) | ADRA1AADRA1BADRA1DADRA2AADRA2C | |
| Fumaric Acid SCHEMBL6367213 | 0.88 | ADRA1A (0.82) | ADRA1AADRA1BADRA1DADRA2AADRA2C | |
| Fumaric Acid SCHEMBL6367224 | 0.88 | ADRA1A (0.82) | ADRA1AADRA1BADRA1DADRA2AADRA2C | |
| Fumaric Acid SCHEMBL6367057 | 0.87 | ADRA1A (0.83) | ADRA1AADRA1BADRA1DADRA2AADRA2C | |
| Fumaric Acid SCHEMBL6367063 | 0.87 | ADRA1A (0.83) | ADRA1AADRA1BADRA1DADRA2AADRA2C | |
| Fumaric Acid SCHEMBL6372755 | 0.86 | ADRA1A (0.65) | ADRA1AADRA1BADRA1DADRA2AADRA2C | |
| Fumaric Acid SCHEMBL6371377 | 0.84 | ADRA1A (0.64) | ADRA1AADRA1BADRA1DADRA2AADRA2C | |
| SCHEMBL6315485 | 0.78 | ADRA1A (1.00) | ADRA1AADRA1BADRA1DADRA2AADRA2C | |
| Fumaric Acid SCHEMBL6366675 | 0.78 | ADRA2B (0.64) | ADRA1AADRA1BADRA1DADRA2AADRA2C |
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-6884801-B1 | Imidazoline derivatives as alpha-1A adrenoceptor ligands | SMITHKLINE BEECHAM CORPORATION (US) | 2005-04-26 | — | — | US | disclosed |