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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 known ✓ | P31645 | 4/20 | 0.36 |
| ▸ | SLC6A2 known ✓ | P23975 | 3/20 | 0.32 |
| ▸ | HRH1 known ✓ | P35367 | 2/20 | 0.31 |
| ▸ | PIM1 | P11309 | 1/20 | 0.32 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.31 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.31 |
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 SCHEMBL9345609 | 1.00 | SLC6A4 (0.36) | SLC6A4PIM1PIM2SLC6A2MMP2 | |
| Fumaric Acid SCHEMBL9346367 | 0.89 | ITGB3 (0.35) | SLC6A4PIM1PIM2SLC6A2ITGB3 | |
| Fumaric Acid SCHEMBL9346349 | 0.89 | ITGB3 (0.35) | SLC6A4PIM1PIM2SLC6A2ITGB3 | |
| Fumaric Acid SCHEMBL9348754 | 0.84 | ITGB3 (0.37) | SLC6A4SLC6A2MMP2MMP9ITGB3 | |
| Fumaric Acid SCHEMBL9348760 | 0.84 | ITGB3 (0.37) | SLC6A4SLC6A2MMP2MMP9ITGB3 | |
| SCHEMBL9348784 | 0.82 | ITGB3 (0.34) | PIM1PIM2MMP2MMP9ITGB3 | |
| Glycine SCHEMBL9349017 | 0.80 | ITGB3 (0.37) | PIM1PIM2MMP2MMP9ITGB3 | |
| SCHEMBL8259490 | 0.80 | MMP2 (0.38) | SLC6A4PIM1PIM2MMP2MMP9 | |
| Alanine SCHEMBL9344287 | 0.80 | ITGB3 (0.36) | SLC6A4PIM1PIM2MMP2MMP9 | |
| Isonipecotic Acid SCHEMBL9344171 | 0.78 | GABRA5 (0.50) | PIM1PIM2MMP2MMP9ITGB3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5280031-A | Cyclic azaaliphatic compounds with a nitroxy function, processes for the preparation thereof and pharmaceutical compositions containing them | BOEHRINGER MANNHEIM GMBH (DE) | 1994-01-18 | — | — | US | disclosed |
| US-5030641-A | Treatment of angina pectoris, hypotensive agents | BOEHRINGER MANNHEIM GMBH (DE) | 1991-07-09 | — | — | US | disclosed |