Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 15/20 | 0.55 |
| ▸ | PIK3R1 | P27986 | 11/20 | 0.55 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.44 |
| ▸ | MTOR | P42345 | 2/20 | 0.42 |
| ▸ | KIT | P10721 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | PIK3CG | P48736 | 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 | |
|---|---|---|---|---|
| SCHEMBL2379788 | 0.90 | PIK3CA (0.67) | PIK3CAPIK3R1PIK3CBMTOR | |
| SCHEMBL2377447 | 0.89 | PIK3CA (0.57) | PIK3CAPIK3R1PIK3CBMTORPIK3CG | |
| SCHEMBL2377845 | 0.88 | PIK3CA (0.49) | PIK3CAPIK3R1PIK3CB | |
| SCHEMBL2377653 | 0.86 | PIK3CA (0.54) | PIK3CAPIK3R1PIK3CBMTOR | |
| SCHEMBL2376070 | 0.86 | PIK3CA (0.58) | PIK3CAPIK3R1PIK3CBMTORPIK3CG | |
| SCHEMBL2378874 | 0.86 | PIK3CA (0.58) | PIK3CAPIK3R1PIK3CB | |
| SCHEMBL2378227 | 0.85 | PIK3CA (0.56) | PIK3CAPIK3R1PIK3CBMTORPIK3CG | |
| SCHEMBL2376411 | 0.85 | PIK3CA (0.58) | PIK3CAPIK3R1PIK3CBMTORPIK3CG | |
| SCHEMBL2378304 | 0.85 | PIK3CA (0.54) | PIK3CAPIK3R1PIK3CBMTORPIK3CG | |
| SCHEMBL2379225 | 0.84 | PIK3CA (0.48) | PIK3CAPIK3R1PIK3CB |
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 |
|---|---|---|---|---|---|---|---|
| US-8022205-B2 | Pyrimidine derivatives as PI3K inhibitor and use thereof | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2011-09-20 | — | — | US | disclosed |