Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 2/20 | 0.65 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.65 |
| ▸ | MAP4K4 | O95819 | 4/20 | 0.54 |
| ▸ | EGFR | P00533 | 5/20 | 0.49 |
| ▸ | TDO2 | P48775 | 1/20 | 0.48 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.48 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | USP2 | O75604 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.47 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | NT5E | P21589 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30568954 | 0.91 | PIK3CA (0.58) | PIK3CAPIK3CDMAP4K4EGFRTDO2 | |
| SCHEMBL28178783 | 0.85 | PIK3CA (0.61) | PIK3CAPIK3CDMAP4K4EGFRTDO2 | |
| SCHEMBL8644295 | 0.84 | PIK3CA (0.73) | PIK3CAPIK3CDMAP4K4EGFRTDO2 | |
| SCHEMBL28139430 | 0.84 | PIK3CA (0.48) | PIK3CAPIK3CDMAP4K4TDO2CYP1A2 | |
| SCHEMBL20687402 | 0.83 | PIK3CD (0.73) | PIK3CAPIK3CDMAP4K4EGFRTDO2 | |
| SCHEMBL17410801 | 0.81 | EGFR (0.60) | PIK3CAPIK3CDEGFRTDO2FGFR4 | |
| SCHEMBL29891394 | 0.81 | EGFR (0.60) | PIK3CAPIK3CDEGFRTDO2FGFR4 | |
| SCHEMBL28178788 | 0.81 | EGFR (0.67) | PIK3CAPIK3CDMAP4K4EGFRTDO2 | |
| SCHEMBL28156873 | 0.81 | PDGFRB (0.55) | PIK3CAPIK3CDMAP4K4EGFRPDGFRB | |
| SCHEMBL30568937 | 0.79 | TDO2 (0.53) | PIK3CAPIK3CDMAP4K4EGFRTDO2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109843858-A | Certain chemical entities, composition and method | 润新生物公司 | 2019-06-04 | — | — | CN | disclosed |