Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | STAT6 | P42226 | 1/20 | 0.37 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 13/20 | 0.36 |
| ▸ | MTOR | P42345 | 12/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 10/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4019431 | 0.89 | PIK3CA (0.45) | ADORA1PIK3CAMTORPIK3CGCHEK2 | |
| SCHEMBL4185149 | 0.84 | PIK3CA (0.53) | PIK3CAMTORPIK3CGPIK3CD | |
| SCHEMBL4020168 | 0.74 | PIK3CA (0.69) | PIK3CAMTORPIK3CGPIK3CD | |
| SCHEMBL4020766 | 0.73 | PIK3CA (0.65) | PIK3CAMTORPIK3CGPIK3CD | |
| SCHEMBL4182834 | 0.72 | PIK3CA (0.69) | PIK3CAMTORPIK3CG | |
| SCHEMBL4026472 | 0.72 | PIK3CA (0.60) | PIK3CAMTORPIK3CGPIK3CD | |
| SCHEMBL7884075 | 0.71 | PIK3CA (0.47) | PIK3CAMTORPIK3CG | |
| SCHEMBL4017855 | 0.71 | PIK3CA (0.53) | PIK3CAMTORPIK3CGPIK3CD | |
| SCHEMBL7884103 | 0.71 | PIK3CA (0.48) | PIK3CAMTORPIK3CG | |
| SCHEMBL7876393 | 0.71 | PDE8A (0.37) | ADORA1 |
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-2009097490-A1 | 1H-PYRAZOLO[3,4-D]PYRIMIDINE, PURINE, 7H-PURIN-8(9H)-ONE, 3H-[1,2,3]TRIAZOLO[4,5-D]PYRIMIDINE, AND THIENO[3,2-D]PYRIMIDINE COMPOUNDS, THEIR USE AS mTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES | WYETH (US) | 2009-08-06 | — | — | WO | disclosed |