Known targets — ChEMBL curated mechanism
ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ATP4AATP4BAXLBTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CHRM2CHRM3CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4FLT3HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3KCNH2KMT2AMAP2K1MAP2K2MEN1MLNRMPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PLK4PPARGRENS1PR1SLC6A2SLC6A3SLC6A4SMOTYK2atpAatpBatpCatpDatpEatpFatpFHatpGpol
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 | |
|---|---|---|---|---|
| ▸ | MEN1 known ✓ | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A known ✓ | Q03164 | 2/20 | 0.41 |
| ▸ | DRD2 known ✓ | P14416 | 2/20 | 0.37 |
| ▸ | DRD1 known ✓ | P21728 | 2/20 | 0.37 |
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.36 |
| ▸ | ADRA2A known ✓ | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B known ✓ | P18089 | 1/20 | 0.36 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.36 |
| ▸ | HTR2A known ✓ | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C known ✓ | P28335 | 1/20 | 0.36 |
| ▸ | HRH1 known ✓ | P35367 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Maleic Acid SCHEMBL9877527 | 1.00 | CYP3A4 (0.45) | CYP3A4HTTMEN1KMT2AMAPK1 | |
| SCHEMBL272823 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL9869384 | 0.77 | — | — | |
| Fumaric Acid SCHEMBL12467794 | 0.76 | DRD2 (0.59) | CYP3A4HTTMEN1KMT2AMAPK1 | |
| Maleic Acid SCHEMBL167958 | 0.76 | DRD2 (0.59) | CYP3A4HTTMEN1KMT2AMAPK1 | |
| Ethyne SCHEMBL9362017 | 0.74 | MAOA (0.37) | DRD2DRD1DRD5ADRA2AADRA2B | |
| Fumaric Acid SCHEMBL7463662 | 0.71 | TSHR (0.43) | CYP3A4HTTMAPTSMN1; SMN2KDM4E | |
| Fumaric Acid SCHEMBL7463657 | 0.71 | TSHR (0.43) | CYP3A4HTTMAPTSMN1; SMN2KDM4E | |
| Fumaric Acid SCHEMBL6625237 | 0.71 | TSHR (0.43) | CYP3A4HTTMAPTSMN1; SMN2KDM4E | |
| Maleic Acid SCHEMBL6625236 | 0.71 | TSHR (0.43) | CYP3A4HTTMAPTSMN1; SMN2KDM4E |
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-5073560-A | SPIRO-ISOXAZOLIDINE DERIVATIVES AS CHOLINERGIC AGENTS | FISONS CORPORATION (US) | 1991-12-17 | — | — | US | disclosed |