Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.31 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL7470295 | 0.74 | NR1H2 (0.34) | NR1H2NR1H3 | |
| SCHEMBL17843416 | 0.72 | CYP3A4 (0.35) | MAPK1CYP3A4 | |
| SCHEMBL30577854 | 0.72 | MAPK1 (0.54) | MAPK1NR1H2CYP3A4HTT | |
| SCHEMBL2495889 | 0.67 | CYP3A4 (0.60) | MAPK1NR1H2NR1H3CYP3A4HTT | |
| SCHEMBL28704785 | 0.67 | CYP3A4 (0.60) | MAPK1NR1H2NR1H3CYP3A4HTT | |
| SCHEMBL31571841 | 0.65 | STS (0.31) | NR1H2NR1H3 | |
| SCHEMBL26694577 | 0.65 | SMN1; SMN2 (0.37) | MAPK1CYP3A4 | |
| SCHEMBL16422844 | 0.64 | STS (0.35) | NR1H2 | |
| SCHEMBL21807057 | 0.64 | TSHR (0.39) | — | |
| SCHEMBL30577846 | 0.63 | MAPK1 (0.38) | MAPK1NR1H2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010062821-A1 | ANTI-VIRAL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE | GLAXOSMITHKLINE LLC (US) | 2010-06-03 | — | — | WO | disclosed |