Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 13/20 | 0.63 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | BRAF | P15056 | 1/20 | 0.48 |
| ▸ | SYK | P43405 | 5/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.46 |
| ▸ | MAPK3 | P27361 | 3/20 | 0.45 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8318575 | 1.00 | EGFR (0.63) | EGFRERBB2HPGDHTTBRAF | |
| SCHEMBL8319428 | 0.92 | EGFR (0.73) | EGFRERBB2HPGDHTTBRAF | |
| SCHEMBL8319697 | 0.90 | EGFR (0.56) | EGFRERBB2HPGDHTTBRAF | |
| SCHEMBL8317876 | 0.90 | EGFR (0.64) | EGFRERBB2HPGDHTT | |
| SCHEMBL8319701 | 0.90 | EGFR (0.56) | EGFRERBB2HPGDHTTBRAF | |
| SCHEMBL8317880 | 0.90 | EGFR (0.64) | EGFRERBB2HPGDHTT | |
| SCHEMBL8318072 | 0.88 | EGFR (0.71) | EGFRERBB2HPGDHTTBRAF | |
| SCHEMBL8318282 | 0.88 | EGFR (0.71) | EGFRERBB2HPGDHTTBRAF | |
| SCHEMBL8313624 | 0.87 | EGFR (0.67) | EGFRERBB2HPGDHTTBRAF | |
| SCHEMBL8319108 | 0.87 | EGFR (0.67) | EGFRERBB2HPGDHTTBRAF |
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 |
|---|---|---|---|---|---|---|---|
| EP-0779888-B1 | PYRIMIDO [5,4-D]PYRIMIDINES, DRUGS CONTAINING THESE COMPOUNDS, THEIR USE, AND PROCESS FOR PREPARING THEM | BOEHRINGER INGELHEIM PHARMA (DE) | 1999-04-28 | — | — | EP | disclosed |