Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 8/20 | 0.51 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.49 |
| ▸ | ERBB3 | P21860 | 1/20 | 0.46 |
| ▸ | FLT3 | P36888 | 5/20 | 0.42 |
| ▸ | TYRO3 | Q06418 | 5/20 | 0.42 |
| ▸ | MERTK | Q12866 | 5/20 | 0.42 |
| ▸ | GAS6 | Q14393 | 5/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.41 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.40 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.40 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.40 |
| ▸ | TUBB | P07437 | 1/20 | 0.40 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.40 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.40 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.40 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.40 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.40 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8801381 | 1.00 | EGFR (0.51) | EGFRTNNI3KERBB3FLT3TYRO3 | |
| SCHEMBL27330845 | 0.94 | TNNI3K (0.54) | EGFRTNNI3KERBB3AURKAAURKB | |
| SCHEMBL8798643 | 0.85 | EGFR (0.55) | EGFRTNNI3KFLT3TYRO3MERTK | |
| SCHEMBL7856313 | 0.85 | TNNI3K (0.49) | EGFRTNNI3KERBB3AURKAAURKB | |
| SCHEMBL8798647 | 0.85 | EGFR (0.55) | EGFRTNNI3KFLT3TYRO3MERTK | |
| SCHEMBL8800460 | 0.85 | EGFR (0.55) | EGFRTNNI3KERBB3ERBB4TUBB4A | |
| SCHEMBL8799768 | 0.82 | TNNI3K (0.56) | EGFRTNNI3KERBB3 | |
| SCHEMBL8799771 | 0.82 | TNNI3K (0.56) | EGFRTNNI3KERBB3 | |
| SCHEMBL8800011 | 0.82 | EGFR (0.54) | EGFRTNNI3KERBB3ERBB4TUBB4A | |
| SCHEMBL7790472 | 0.79 | RAB9A (0.45) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1047778-C | Pyrimido [5-4-d] pyrimidines, drugs containing these compounds, their use and process for preparing them | THOMAE GMBH DR K (DE) | 1999-12-29 | — | — | CN | claimed |
| EP-0779888-A1 | PYRIMIDO [5,4-D]PYRIMIDINES, DRUGS CONTAINING THESE COMPOUNDS, THEIR USE, AND PROCESS FOR PREPARING THEM | Dr. Karl Thomae GmbH (DE) | 1997-06-25 | — | — | EP | disclosed |
| WO-1996007657-A1 | PYRIMIDO[5,4-D]PYRIMIDINES, DRUGS CONTAINING THESE COMPOUNDS, THEIR USE, AND PROCESS FOR PREPARING THEM | DR. KARL THOMAE GMBH (DE) | 1996-03-14 | — | — | WO | disclosed |