Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.38 |
| ▸ | GHSR | Q92847 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.36 |
| ▸ | LIMK1 | P53667 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8098261 | 0.89 | MTOR (0.43) | KDM4EMEN1ALDH1A1MAPTHPGD | |
| SCHEMBL8092884 | 0.87 | KDR (0.41) | EPHX2PIK3CDNAMPT | |
| SCHEMBL8083714 | 0.84 | EPHX1 (0.45) | CA12CA1CA2CA9MEN1 | |
| SCHEMBL8090594 | 0.84 | PIK3CD (0.40) | MEN1MAPTKMT2AHDAC3HDAC1 | |
| SCHEMBL8089827 | 0.83 | PIK3CD (0.37) | ROCK2MAPTPIK3CD | |
| SCHEMBL8099890 | 0.82 | GHSR (0.39) | CA12CA1CA2CA9ROCK2 | |
| SCHEMBL8081794 | 0.82 | PIK3CA (0.44) | NAMPT | |
| SCHEMBL8098188 | 0.82 | CA12 (0.44) | CA12CA1CA2CA9ROCK2 | |
| SCHEMBL8089531 | 0.81 | CA12 (0.43) | CA12CA1CA2CA9ROCK2 | |
| SCHEMBL8097252 | 0.81 | CA12 (0.43) | CA12CA1CA2CA9ROCK2 |
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-2009007748-A2 | TRISUBSTITUTED PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF PROLIFERATIVE DISEASES | ASTRAZENECA AB (SE) | 2009-01-15 | — | — | WO | disclosed |