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 | |
|---|---|---|---|---|
| ▸ | HTR2A known ✓ | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C known ✓ | P28335 | 1/20 | 0.37 |
| ▸ | DRD2 known ✓ | P14416 | 3/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.57 |
| ▸ | DRD4 | P21917 | 5/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.39 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.39 |
| ▸ | BCL2 | P10415 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.35 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 SCHEMBL9303722 | 1.00 | ALOX5 (0.57) | ALOX5DRD4MCL1BCL2L1BCL2 | |
| SCHEMBL8557119 | 0.94 | ALOX5 (0.64) | ALOX5DRD4MCL1BCL2L1BCL2 | |
| SCHEMBL9305812 | 0.88 | ALOX5 (0.63) | ALOX5DRD4MCL1BCL2L1BCL2 | |
| SCHEMBL8560149 | 0.86 | ALOX5 (0.63) | ALOX5DRD4MCL1BCL2L1HTR2A | |
| SCHEMBL8557600 | 0.85 | ALOX5 (0.59) | ALOX5DRD4HTR2AHTR2CDRD2 | |
| SCHEMBL8557565 | 0.83 | ALOX5 (0.77) | ALOX5DRD4MCL1BCL2L1HTR2A | |
| Hydrochloric Acid SCHEMBL8555007 | 0.82 | ALOX5 (0.75) | ALOX5DRD4MCL1BCL2L1HTR2A | |
| SCHEMBL8554776 | 0.81 | ALOX5 (0.73) | ALOX5DRD4MCL1BCL2L1HTR2A | |
| SCHEMBL9305806 | 0.80 | ALOX5 (0.62) | ALOX5DRD4MCL1BCL2L1BCL2 | |
| Hydrochloric Acid SCHEMBL8555946 | 0.80 | ALOX5 (0.71) | ALOX5DRD4MCL1BCL2L1HTR2A |
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-5324725-A | Antiinflammatory agent, antiallergen | KALI-CHEMIE PHARMA GMBH (DE) | 1994-06-28 | — | — | US | disclosed |