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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 known ✓ | P14416 | 1/20 | 0.42 |
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A known ✓ | Q03164 | 1/20 | 0.42 |
| ▸ | CCR5 | P51681 | 5/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.48 |
| ▸ | HTR7 | P34969 | 2/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 SCHEMBL7459694 | 1.00 | CCR5 (0.49) | CCR5OPRM1HTR7SIGMAR1DRD2 | |
| Fumaric Acid SCHEMBL7462667 | 0.87 | CCR5 (0.46) | CCR5HTR7DRD2HTT | |
| Fumaric Acid SCHEMBL7462660 | 0.87 | CCR5 (0.46) | CCR5HTR7DRD2HTT | |
| Fumaric Acid SCHEMBL7463884 | 0.86 | CHRM2 (0.48) | CCR5OPRM1DRD2BRD4 | |
| Fumaric Acid SCHEMBL7463875 | 0.86 | CHRM2 (0.48) | CCR5OPRM1DRD2BRD4 | |
| Fumaric Acid SCHEMBL7464023 | 0.84 | CCR5 (0.47) | CCR5SIGMAR1DRD2MEN1KMT2A | |
| Fumaric Acid SCHEMBL7464032 | 0.84 | CCR5 (0.47) | CCR5SIGMAR1DRD2MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL7468181 | 0.83 | CCR5 (0.50) | CCR5CYP2D6HTT | |
| SCHEMBL7455494 | 0.82 | CCR5 (0.49) | CCR5SIGMAR1MEN1KMT2AHTT | |
| Hydrochloric Acid SCHEMBL7465772 | 0.82 | CCR5 (0.70) | CCR5OPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1180513-A1 | CYCLIC AMIDE COMPOUNDS, PROCESS FOR THE PREPARATION OF THE SAME AND USES THEREOF | Takeda Chemical Industries, Ltd. (JP) | 2002-02-20 | — | — | EP | disclosed |