Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 1/20 | 0.35 |
| ▸ | GSK3A | P49840 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.33 |
| ▸ | CDK7 | P50613 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15400495 | 0.89 | EGFR (0.34) | GSK3AGSK3BAURKAAURKB | |
| SCHEMBL9941262 | 0.82 | MAPK3 (0.38) | PDE5AGSK3AGSK3B | |
| SCHEMBL15401021 | 0.82 | MAPK3 (0.38) | PDE5AGSK3AGSK3B | |
| SCHEMBL15400835 | 0.81 | GSK3A (0.54) | GSK3AGSK3B | |
| SCHEMBL9970823 | 0.78 | BTK (0.34) | GRM5AURKAAURKBCDK7 | |
| SCHEMBL15401097 | 0.78 | GSK3A (0.48) | GSK3AGSK3B | |
| SCHEMBL15400687 | 0.78 | GSK3A (0.42) | GSK3AGSK3B | |
| SCHEMBL9940843 | 0.77 | GSK3A (0.49) | GSK3AGSK3B | |
| SCHEMBL9940842 | 0.77 | GSK3A (0.49) | GSK3AGSK3B | |
| SCHEMBL15400308 | 0.77 | HTR3A (0.37) | PDE5AGRM5AURKAAURKB |
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-8871774-B2 | Inhibitors of influenza viruses replication | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2014-10-28 | — | — | US | disclosed |