Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 1/20 | 0.45 |
| ▸ | ATR | Q13535 | 7/20 | 0.44 |
| ▸ | RAF1 | P04049 | 5/20 | 0.40 |
| ▸ | BRAF | P15056 | 5/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.40 |
| ▸ | MTOR | P42345 | 2/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.39 |
| ▸ | TDO2 | P48775 | 1/20 | 0.39 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1027578 | 0.88 | AKT1 (0.46) | AKT1ATRRAF1BRAFPIK3CA | |
| SCHEMBL1026724 | 0.84 | PIK3CA (0.50) | AKT1ATRPIK3CATDO2 | |
| SCHEMBL1029136 | 0.83 | ATR (0.47) | ATRPIK3CATDO2 | |
| SCHEMBL1025207 | 0.81 | ATR (0.47) | ATRRAF1BRAFPIK3CA | |
| SCHEMBL1025702 | 0.80 | PIK3CA (0.49) | AKT1ATRPIK3CATDO2 | |
| SCHEMBL1027000 | 0.79 | PIK3CA (0.53) | ATRPIK3CATDO2 | |
| SCHEMBL1026930 | 0.79 | PIK3CA (0.53) | ATRPIK3CAPIK3CGTDO2PIK3CB | |
| SCHEMBL367925 | 0.79 | ATR (0.46) | ATRPIK3CAMTORPIK3CGPIK3CB | |
| SCHEMBL1028070 | 0.78 | PIK3CA (0.48) | ATRPIK3CAMTORPIK3CGPIK3CB | |
| SCHEMBL1029698 | 0.77 | PIK3CA (0.60) | ATRPIK3CAPIK3CB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2150546-B1 | PYRIMIDINE DERIVATIVES AS INHIBITORS OF PHOSPHATIDYLINOSITOL-3-KINASE | HOFFMANN LA ROCHE (CH) | 2011-01-19 | — | — | EP | claimed |