Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 12/20 | 0.60 |
| ▸ | TNNI3K | Q59H18 | 5/20 | 0.58 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | ERBB3 | P21860 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1387302 | 0.89 | EGFR (0.72) | EGFRTNNI3KMEN1NPC1RAB9A | |
| SCHEMBL27334594 | 0.84 | TNNI3K (0.59) | EGFRTNNI3KMEN1NPC1RAB9A | |
| SCHEMBL8798272 | 0.83 | EGFR (0.66) | EGFRTNNI3KMEN1NPC1RAB9A | |
| SCHEMBL2782010 | 0.83 | EGFR (0.65) | EGFRTNNI3KMEN1NPC1RAB9A | |
| SCHEMBL27318729 | 0.80 | CFD (0.49) | EGFRTNNI3KMEN1NPC1RAB9A | |
| SCHEMBL690632 | 0.80 | EGFR (0.62) | EGFRTNNI3KMEN1NPC1RAB9A | |
| SCHEMBL7771269 | 0.80 | EGFR (0.66) | EGFRTNNI3KPOLBMEN1NPC1 | |
| SCHEMBL8798667 | 0.80 | EGFR (0.61) | EGFRTNNI3KRAB9ANPSR1HTT | |
| SCHEMBL7777342 | 0.79 | EGFR (0.64) | EGFRTNNI3KMEN1NPC1RAB9A | |
| SCHEMBL2279629 | 0.78 | EGFR (0.59) | EGFRTNNI3KNPC1NPSR1HTT |
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-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 |