Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3A | P49840 | 10/20 | 0.34 |
| ▸ | GSK3B | P49841 | 10/20 | 0.34 |
| ▸ | FLT3 | P36888 | 9/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 7/20 | 0.32 |
| ▸ | JAK2 | O60674 | 5/20 | 0.32 |
| ▸ | SRC | P12931 | 5/20 | 0.32 |
| ▸ | PRKACA | P17612 | 4/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 4/20 | 0.32 |
| ▸ | PLK1 | P53350 | 4/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.32 |
| ▸ | KDR | P35968 | 3/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.30 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.30 |
| ▸ | CDK2 | P24941 | 1/20 | 0.30 |
| ▸ | IRAK4 | Q9NWZ3 | 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 | |
|---|---|---|---|---|
| SCHEMBL9970822 | 0.85 | GSK3A (0.41) | GSK3AGSK3BFLT3JAK2SRC | |
| SCHEMBL15401009 | 0.85 | GSK3A (0.41) | GSK3AGSK3BFLT3JAK2SRC | |
| SCHEMBL9941696 | 0.85 | GSK3A (0.41) | GSK3AGSK3BFLT3JAK2SRC | |
| SCHEMBL9970907 | 0.82 | TP53 (0.37) | — | |
| SCHEMBL9970850 | 0.81 | GSK3A (0.43) | GSK3AGSK3B | |
| SCHEMBL9970854 | 0.81 | GSK3A (0.43) | GSK3AGSK3B | |
| SCHEMBL15401021 | 0.78 | MAPK3 (0.38) | GSK3AGSK3BJAK2 | |
| SCHEMBL9941262 | 0.78 | MAPK3 (0.38) | GSK3AGSK3BJAK2 | |
| SCHEMBL9970866 | 0.78 | GSK3A (0.38) | GSK3AGSK3BFLT3JAK2SRC | |
| SCHEMBL15400593 | 0.77 | GSK3A (0.46) | GSK3AGSK3B |
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-2012083121-A1 | INHIBITORS OF INFLUENZA VIRUSES REPLICATION | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2012-06-21 | — | — | WO | disclosed |