Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.42 |
| ▸ | CA2 | P00918 | 4/20 | 0.42 |
| ▸ | CA9 | Q16790 | 4/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 9/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL3787119 | 0.89 | KCNH3 (0.39) | CA1CA2CA9PTGS2MAPT | |
| SCHEMBL3782046 | 0.85 | MPO (0.45) | PTGS2MAPTGAATP53 | |
| SCHEMBL3776179 | 0.81 | MPO (0.39) | — | |
| SCHEMBL3780333 | 0.80 | CNR2 (0.48) | MAPTGAATP53 | |
| SCHEMBL3781754 | 0.80 | PTGS2 (0.46) | PTGS2PTGS1MAPTGAATP53 | |
| SCHEMBL3788039 | 0.79 | MAPT (0.44) | PTGS2MAPTGAATP53 | |
| SCHEMBL3701571 | 0.79 | HRH4 (0.44) | PTGS2PTGS1MAPT | |
| SCHEMBL3777960 | 0.78 | GHSR (0.40) | PTGS2PTGS1 | |
| SCHEMBL3713217 | 0.78 | KCNH3 (0.41) | PTGS1MAPT | |
| SCHEMBL4408652 | 0.76 | CA1 (0.53) | CA1CA2CA9PTGS2PTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010083645-A1 | PYRIMIDO[5,4-e][1,2,4]TRIAZINES AND USES THEREOF | SHANGHAI TARGETDRUG CO., LTD (CN) | 2010-07-29 | — | — | WO | claimed |
| WO-2010083645-A1 | PYRIMIDO[5,4-e][1,2,4]TRIAZINES AND USES THEREOF | SHANGHAI TARGETDRUG CO., LTD (CN) | 2010-07-29 | — | — | WO | disclosed |