Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTOR | P42345 | 20/20 | 0.72 |
| ▸ | PIK3CA | P42336 | 19/20 | 0.72 |
| ▸ | PIK3CG | P48736 | 16/20 | 0.72 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.66 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.66 |
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 | |
|---|---|---|---|---|
| SCHEMBL32179 | 0.84 | MTOR (1.00) | MTORPIK3CAPIK3CG | |
| SCHEMBL32189 | 0.83 | MTOR (1.00) | MTORPIK3CAPIK3CG | |
| SCHEMBL32350 | 0.83 | PIK3CA (0.84) | MTORPIK3CAPIK3CG | |
| SCHEMBL13828917 | 0.83 | MTOR (0.58) | MTORPIK3CAPIK3CG | |
| SCHEMBL32624 | 0.82 | PIK3CA (0.82) | MTORPIK3CAPIK3CG | |
| SCHEMBL32400 | 0.82 | MTOR (1.00) | MTORPIK3CAPIK3CGPIK3CDPIK3CB | |
| SCHEMBL32791 | 0.82 | PIK3CA (1.00) | MTORPIK3CAPIK3CG | |
| SCHEMBL32467 | 0.82 | PIK3CA (1.00) | MTORPIK3CAPIK3CG | |
| SCHEMBL32289 | 0.82 | PIK3CA (1.00) | MTORPIK3CAPIK3CG | |
| SCHEMBL13828958 | 0.81 | MTOR (0.58) | MTOR |
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 |
|---|---|---|---|---|---|---|---|
| CN-113045559-B | Diaryl urea PI3K alpha/mTOR double-target inhibitor and pharmaceutical composition and application thereof | 贵州医科大学 | 2022-05-20 | — | — | CN | disclosed |
| CN-113045559-A | Diaryl urea PI3K alpha/mTOR double-target inhibitor and pharmaceutical composition and application thereof | 贵州医科大学 | 2021-06-29 | — | — | CN | disclosed |