Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17988542 | 0.92 | — | — | |
| SCHEMBL18133589 | 0.88 | — | — | |
| SCHEMBL17991909 | 0.83 | HTT (0.40) | HTTSMN1; SMN2CYP3A4 | |
| SCHEMBL17988562 | 0.83 | CYP3A4 (0.30) | CYP3A4 | |
| SCHEMBL18133605 | 0.80 | ATM (0.36) | — | |
| SCHEMBL17988543 | 0.78 | HTT (0.39) | HTTSMN1; SMN2CYP3A4 | |
| SCHEMBL17991891 | 0.76 | HCAR2 (0.40) | HTTSMN1; SMN2 | |
| SCHEMBL17988536 | 0.74 | HCAR2 (0.47) | — | |
| SCHEMBL17988539 | 0.73 | HCAR2 (0.37) | HTT | |
| SCHEMBL17988537 | 0.73 | HCAR2 (0.34) | SMN1; SMN2 |
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-9409872-B1 | Fumarate compounds, pharmaceutical compositions thereof, and methods of use | Nguyen, Mark Quang (US) | 2016-08-09 | — | — | US | disclosed |