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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A known ✓ | P28223 | 2/20 | 0.41 |
| ▸ | HTR2C known ✓ | P28335 | 2/20 | 0.41 |
| ▸ | DRD2 known ✓ | P14416 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.47 |
| ▸ | PTGIR | P43119 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 3/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
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 SCHEMBL8716589 | 1.00 | HSD11B1 (0.47) | HSD11B1PTGIRACHEOPRM1OPRD1 | |
| SCHEMBL8710939 | 0.95 | HSD11B1 (0.52) | HSD11B1PTGIRACHEOPRM1OPRD1 | |
| Fumaric Acid SCHEMBL8714256 | 0.92 | PTGIR (0.51) | HSD11B1PTGIRACHEOPRM1DRD2 | |
| Fumaric Acid SCHEMBL8714261 | 0.92 | PTGIR (0.51) | HSD11B1PTGIRACHEOPRM1DRD2 | |
| Fumaric Acid SCHEMBL9233003 | 0.90 | HSD11B1 (0.49) | HSD11B1PTGIRACHEOPRM1OPRD1 | |
| Fumaric Acid SCHEMBL9232997 | 0.90 | HSD11B1 (0.49) | HSD11B1PTGIRACHEOPRM1OPRD1 | |
| Fumaric Acid SCHEMBL8710683 | 0.89 | HSD11B1 (0.47) | HSD11B1PTGIRACHE | |
| Fumaric Acid SCHEMBL8711294 | 0.89 | HSD11B1 (0.47) | HSD11B1PTGIRACHE | |
| Maleic Acid SCHEMBL8710680 | 0.89 | HSD11B1 (0.47) | HSD11B1PTGIRACHE | |
| SCHEMBL8716656 | 0.88 | HSD11B1 (0.54) | HSD11B1PTGIRACHEOPRM1OPRD1 |
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-5728835-A | HYPOTENSIVE AGENTS; ANTIISCHEMIC AGENTS | TOA EIYO, LTD. (JP) | 1998-03-17 | — | — | US | disclosed |
| EP-0661266-A1 | Substituted cyclic amine compounds as 5HT2 antagonists | TOA EIYO LTD. (JP) | 1995-07-05 | — | — | EP | disclosed |