Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 5/20 | 0.59 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | BRAF | P15056 | 5/20 | 0.53 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.46 |
| ▸ | BTK | Q06187 | 1/20 | 0.45 |
| ▸ | SYK | P43405 | 5/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.41 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.40 |
| ▸ | MELK | Q14680 | 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 | |
|---|---|---|---|---|
| SCHEMBL8316797 | 1.00 | EGFR (0.59) | EGFRERBB2HPGDHTTBRAF | |
| SCHEMBL8319506 | 0.92 | EGFR (0.70) | EGFRERBB2HPGDHTTBRAF | |
| SCHEMBL8319512 | 0.92 | EGFR (0.70) | EGFRERBB2HPGDHTTBRAF | |
| SCHEMBL8317032 | 0.89 | EGFR (0.60) | EGFRERBB2HPGDHTTBRAF | |
| SCHEMBL8317027 | 0.89 | EGFR (0.60) | EGFRERBB2HPGDHTTBRAF | |
| SCHEMBL8317568 | 0.89 | CSNK2A1 (0.54) | EGFRERBB2HPGDHTTBRAF | |
| SCHEMBL8317572 | 0.89 | CSNK2A1 (0.54) | EGFRERBB2HPGDHTTBRAF | |
| SCHEMBL8316240 | 0.88 | EGFR (0.69) | EGFRERBB2HPGDHTTBRAF | |
| SCHEMBL8316938 | 0.86 | EGFR (0.61) | EGFRERBB2HPGDHTTBRAF | |
| SCHEMBL8316932 | 0.86 | EGFR (0.61) | 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 3 patents. 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 |
| 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 |