Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 7/20 | 0.56 |
| ▸ | EGFR | P00533 | 1/20 | 0.50 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | MAPK3 | P27361 | 2/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | CDK7 | P50613 | 1/20 | 0.39 |
| ▸ | CDK9 | P50750 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.38 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.38 |
| ▸ | GSK3A | P49840 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6993881 | 0.88 | EGFR (0.56) | BRAFEGFRERBB2HPGDHTT | |
| SCHEMBL6993890 | 0.88 | EGFR (0.56) | BRAFEGFRERBB2HPGDHTT | |
| SCHEMBL6996623 | 0.86 | BRAF (0.56) | BRAFEGFRERBB2HPGDHTT | |
| SCHEMBL6996614 | 0.86 | BRAF (0.56) | BRAFEGFRERBB2HPGDHTT | |
| SCHEMBL6999541 | 0.84 | EGFR (0.52) | BRAFEGFRERBB2HPGDHTT | |
| SCHEMBL6999546 | 0.84 | EGFR (0.52) | BRAFEGFRERBB2HPGDHTT | |
| SCHEMBL8315973 | 0.81 | EGFR (0.57) | BRAFEGFRERBB2HPGDHTT | |
| SCHEMBL8315965 | 0.81 | EGFR (0.57) | BRAFEGFRERBB2HPGDHTT | |
| SCHEMBL8315344 | 0.80 | EGFR (0.64) | BRAFEGFRERBB2HPGDHTT | |
| SCHEMBL8315348 | 0.80 | EGFR (0.64) | BRAFEGFRERBB2HPGDHTT |
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 |