Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 2/20 | 0.37 |
| ▸ | MTOR | P42345 | 13/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 11/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL629451 | 0.90 | PTGS2 (0.39) | ATRMTORPIK3CAPIK3CGPTGS2 | |
| SCHEMBL629371 | 0.85 | MEN1 (0.43) | ATRMTORPIK3CAPIK3CGPTGS2 | |
| SCHEMBL627851 | 0.82 | MTOR (0.53) | MTORPIK3CAPIK3CG | |
| SCHEMBL628413 | 0.79 | PIK3CA (0.56) | MTORPIK3CAPIK3CG | |
| SCHEMBL7883148 | 0.79 | CYP1A2 (0.49) | PTGS2 | |
| SCHEMBL628562 | 0.78 | PIK3CA (0.64) | MTORPIK3CAPIK3CG | |
| SCHEMBL628601 | 0.77 | PIK3CA (0.66) | MTORPIK3CAPIK3CG | |
| SCHEMBL629216 | 0.76 | MTOR (0.67) | MTORPIK3CAPIK3CG | |
| SCHEMBL9607534 | 0.76 | MTOR (0.38) | ATRMTORPIK3CAPIK3CG | |
| SCHEMBL628448 | 0.69 | PIK3CA (0.42) | ATRMTORPIK3CAPIK3CG |
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-2010120998-A1 | PYRIMIDINE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES | WYETH LLC (US) | 2010-10-21 | — | — | WO | disclosed |