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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 known ✓ | P14416 | 4/20 | 0.46 |
| ▸ | MEN1 known ✓ | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A known ✓ | Q03164 | 2/20 | 0.45 |
| ▸ | HTR2A known ✓ | P28223 | 3/20 | 0.44 |
| ▸ | HRH1 known ✓ | P35367 | 3/20 | 0.44 |
| ▸ | MLNR known ✓ | O43193 | 1/20 | 0.44 |
| ▸ | ADRB1 known ✓ | P08588 | 1/20 | 0.44 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.44 |
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.44 |
| ▸ | HTR2B known ✓ | P41595 | 1/20 | 0.44 |
| ▸ | KCNH2 known ✓ | Q12809 | 1/20 | 0.44 |
| ▸ | HTR2C known ✓ | P28335 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 5/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | FAAH | O00519 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
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 SCHEMBL9601340 | 1.00 | DRD3 (0.46) | DRD3DRD2SIGMAR1CYP3A4CYP2D6 | |
| Fumaric Acid SCHEMBL9602972 | 0.87 | DRD3 (0.46) | DRD3DRD2SIGMAR1CYP3A4CYP2D6 | |
| Fumaric Acid SCHEMBL9602977 | 0.87 | DRD3 (0.46) | DRD3DRD2SIGMAR1CYP3A4CYP2D6 | |
| SCHEMBL7794415 | 0.85 | DRD3 (0.53) | DRD3DRD2SIGMAR1CYP3A4CYP2D6 | |
| Fumaric Acid SCHEMBL9602421 | 0.84 | DRD3 (0.49) | DRD3DRD2SIGMAR1CYP3A4CYP2D6 | |
| Fumaric Acid SCHEMBL9602417 | 0.84 | DRD3 (0.49) | DRD3DRD2SIGMAR1CYP3A4CYP2D6 | |
| Fumaric Acid SCHEMBL9601828 | 0.84 | KMT2A (0.46) | DRD3DRD2SIGMAR1CYP3A4CYP2D6 | |
| Fumaric Acid SCHEMBL9601839 | 0.84 | KMT2A (0.46) | DRD3DRD2SIGMAR1CYP3A4CYP2D6 | |
| Alcohol SCHEMBL9600777 | 0.83 | KMT2A (0.54) | DRD3DRD2SIGMAR1CYP3A4CYP2D6 | |
| SCHEMBL7767918 | 0.83 | LMNA (0.53) | DRD3DRD2SIGMAR1CYP3A4CYP2D6 |
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-0308476-B1 | BISPHENYLALKYLPIPERAZINE DERIVATIVES, A METHOD OF THEIR PREPARATION AND A PHARMACEUTICAL PREPARATION | Kabi Pharmacia AB (SE) | 1993-02-03 | — | — | EP | disclosed |
| US-4937245-A | ANTIDEPRESSANTS, ANXIOLYTIC AGENTS | FEX TOMAS (SE) | 1990-06-26 | — | — | US | disclosed |