Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 2/20 | 0.49 |
| ▸ | MTOR | P42345 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 6/20 | 0.46 |
| ▸ | CA9 | Q16790 | 6/20 | 0.46 |
| ▸ | CA12 | O43570 | 5/20 | 0.46 |
| ▸ | CA1 | P00915 | 5/20 | 0.46 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | GHSR | Q92847 | 2/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8218182 | 0.89 | PIK3CA (0.51) | PIK3CAMTORCA2CA9CA12 | |
| SCHEMBL8217566 | 0.89 | PIK3CA (0.47) | PIK3CAMTORCA2CA9CA12 | |
| SCHEMBL8219760 | 0.88 | PIK3CA (0.51) | PIK3CAMTORCA2CA9CA12 | |
| SCHEMBL8215098 | 0.86 | PIK3CA (0.50) | PIK3CAMTORCA2CA9CA12 | |
| SCHEMBL8211601 | 0.86 | PIK3CA (0.48) | PIK3CAMTORCA2CA9CA12 | |
| SCHEMBL8215433 | 0.85 | MTOR (0.49) | PIK3CAMTORCA2CA9CA12 | |
| SCHEMBL8221081 | 0.84 | PIK3CA (0.47) | PIK3CAMTORCA2CA9CA12 | |
| SCHEMBL8084637 | 0.84 | CA12 (0.45) | PIK3CAMTORCA2CA9CA12 | |
| SCHEMBL11924820 | 0.84 | CA12 (0.45) | PIK3CAMTORCA2CA9CA12 | |
| SCHEMBL8218892 | 0.84 | PIK3CA (0.48) | PIK3CAMTORCA2CA9CA12 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2057140-B1 | MORPHOLINO PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF PROLIFERATIVE DISORDERS | ASTRAZENECA AB (SE) | 2012-08-08 | — | — | EP | disclosed |
| WO-2008023159-A1 | MORPHOLINO PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF PROLIFERATIVE DISORDERS | ASTRAZENECA AB (SE) | 2008-02-28 | — | — | WO | disclosed |