Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | GHSR | Q92847 | 2/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 7/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.35 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL8098188 | 0.89 | CA12 (0.44) | CA12CA1CA2CA9GHSR | |
| SCHEMBL8089531 | 0.88 | CA12 (0.43) | CA12CA1CA2CA9GHSR | |
| SCHEMBL8090572 | 0.88 | PIK3CD (0.41) | PIK3CDPIK3CAEPHX2 | |
| SCHEMBL8091998 | 0.87 | KIF11 (0.40) | PIK3CDPIK3CAKDM4EMEN1ALDH1A1 | |
| SCHEMBL8097252 | 0.86 | CA12 (0.43) | CA12CA1CA2CA9GHSR | |
| SCHEMBL8091781 | 0.86 | CA12 (0.43) | CA12CA1CA2CA9GHSR | |
| SCHEMBL8097694 | 0.86 | CYP3A4 (0.42) | CA12CA1CA2CA9PIK3CD | |
| SCHEMBL8106295 | 0.85 | CA12 (0.42) | CA12CA1CA2CA9GHSR | |
| SCHEMBL8096016 | 0.85 | PIK3CD (0.43) | GHSRPIK3CDPIK3CAHDAC3HDAC1 | |
| SCHEMBL8096026 | 0.85 | POLB (0.40) | PIK3CDPIK3CAKDM4EMEN1ALDH1A1 |
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 |