Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 19/20 | 0.51 |
| ▸ | PIK3CD | O00329 | 10/20 | 0.41 |
| ▸ | PIK3CG | P48736 | 9/20 | 0.41 |
| ▸ | PIK3R2 | O00459 | 1/20 | 0.40 |
| ▸ | PIK3C2B | O00750 | 1/20 | 0.40 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 1/20 | 0.40 |
| ▸ | PIK3C3 | Q8NEB9 | 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 | |
|---|---|---|---|---|
| SCHEMBL1528063 | 0.81 | PIK3CA (0.77) | PIK3CAPIK3CDPIK3CG | |
| SCHEMBL1528448 | 0.80 | PIK3CA (0.46) | PIK3CAPIK3CDPIK3CG | |
| SCHEMBL1528113 | 0.79 | PIK3CA (0.46) | PIK3CAPIK3CDPIK3CG | |
| SCHEMBL1528066 | 0.78 | PIK3CD (0.47) | PIK3CAPIK3CDPIK3CG | |
| SCHEMBL16550524 | 0.78 | PIK3CA (0.44) | PIK3CAPIK3CDPIK3CG | |
| SCHEMBL16550492 | 0.76 | PIK3CA (0.48) | PIK3CAPIK3CDPIK3CGPIK3R2PIK3C2B | |
| SCHEMBL11967359 | 0.76 | PIK3CA (0.54) | PIK3CAPIK3CDPIK3CG | |
| SCHEMBL16550508 | 0.74 | PIK3CD (0.43) | PIK3CAPIK3CDPIK3CG | |
| SCHEMBL1528665 | 0.73 | PIK3CA (0.41) | PIK3CAPIK3CDPIK3CG | |
| SCHEMBL1528223 | 0.73 | PIK3CA (0.48) | PIK3CAPIK3CD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2483278-A1 | BENZOXAZEPIN PI3K INHIBITOR COMPOUNDS AND METHODS OF USE | F. Hoffmann-La Roche AG (CH) | 2012-08-08 | — | — | EP | disclosed |
| WO-2011036280-A1 | BENZOXAZEPIN PI3K INHIBITOR COMPOUNDS AND METHODS OF USE | F. HOFFMANN-LA ROCHE AG (CH) | 2011-03-31 | — | — | WO | disclosed |