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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 known ✓ | P35367 | 12/20 | 0.46 |
| ▸ | DRD2 known ✓ | P14416 | 7/20 | 0.46 |
| ▸ | HRH2 | P25021 | 18/20 | 0.48 |
| ▸ | HRH4 | Q9H3N8 | 14/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 12/20 | 0.46 |
| ▸ | DRD3 | P35462 | 7/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
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 SCHEMBL9871662 | 1.00 | HRH2 (0.48) | HRH2HRH4HRH1HRH3DRD2 | |
| Fumaric Acid SCHEMBL9872705 | 0.96 | HRH2 (0.49) | HRH2HRH4HRH1HRH3DRD2 | |
| Fumaric Acid SCHEMBL7270229 | 0.96 | HRH2 (0.49) | HRH2HRH4HRH1HRH3DRD2 | |
| Hydrochloric Acid SCHEMBL7298682 | 0.90 | HRH2 (0.47) | HRH2HRH4HRH1HRH3DRD2 | |
| Fumaric Acid SCHEMBL7277781 | 0.82 | HRH2 (0.52) | HRH2HRH4HRH1HRH3DRD2 | |
| Fumaric Acid SCHEMBL9872600 | 0.82 | HRH2 (0.52) | HRH2HRH4HRH1HRH3DRD2 | |
| Hydrochloric Acid SCHEMBL7304957 | 0.77 | ALDH1A1 (0.53) | DRD2DRD3OPRM1OPRD1OPRK1 | |
| Cadaverine Tartrate SCHEMBL7396266 | 0.74 | HRH2 (0.38) | HRH2HRH4HRH1HRH3DRD2 | |
| SCHEMBL31612255 | 0.73 | HRH2 (0.58) | HRH2HRH4HRH1HRH3DRD2 | |
| Hydrochloric Acid SCHEMBL7268936 | 0.73 | ALDH1A1 (0.54) | DRD2DRD3OPRM1OPRD1OPRK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0409048-B1 | Aminoalkyl substituted 2-aminothiazoles and medicines containing them | BASF AG (DE) | 1995-01-11 | — | — | EP | disclosed |
| US-5071864-A | Administering for high blood pressure and central nervous syst em disorders | BASF AKTIENGESELLSCHAFT (DE) | 1991-12-10 | — | — | US | disclosed |
| EP-0409048-A2 | Aminoalkyl substituted 2-aminothiazoles and medicines containing them | BASF Aktiengesellschaft (DE) | 1991-01-23 | — | — | EP | disclosed |