Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 7/20 | 0.69 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.62 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.61 |
| ▸ | RET | P07949 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 3/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | MAOB | P27338 | 1/20 | 0.56 |
| ▸ | NOS1 | P29475 | 1/20 | 0.56 |
| ▸ | RAF1 | P04049 | 1/20 | 0.55 |
| ▸ | BRAF | P15056 | 1/20 | 0.55 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.53 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.52 |
| ▸ | HSF1 | Q00613 | 1/20 | 0.52 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.50 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8976301 | 0.99 | EGFR (0.68) | EGFRALKMKNK1RETMAPT | |
| Hydrochloric Acid SCHEMBL8976403 | 0.83 | EGFR (0.67) | EGFRALKMAPTALDH1A1HTT | |
| SCHEMBL173234 | 0.82 | EGFR (0.60) | EGFRMKNK1RETRAF1BRAF | |
| SCHEMBL8096187 | 0.82 | EGFR (1.00) | EGFRMKNK1RETRAF1BRAF | |
| SCHEMBL3585835 | 0.82 | ABCG2 (0.70) | ABCG2ROCK2 | |
| SCHEMBL3587306 | 0.81 | ABCG2 (0.62) | MAPTPOLBMAOBNOS1ABCG2 | |
| SCHEMBL15050482 | 0.80 | RET (0.76) | EGFRMKNK1RETL3MBTL1RAF1 | |
| SCHEMBL2835747 | 0.79 | EGFR (0.74) | EGFRMKNK1RETRAF1BRAF | |
| SCHEMBL29516907 | 0.79 | EGFR (0.74) | EGFRMKNK1RETRAF1BRAF | |
| SCHEMBL8976231 | 0.79 | EGFR (0.69) | EGFRALKMAPTALDH1A1HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-5580870-A | ANTICARCINOGENIC AGENTS | ZENECA LIMITED (GB) | 1996-12-03 | — | — | US | disclosed |
| EP-0602851-B1 | Quinazoline derivatives | ZENECA LTD (GB) | 1996-10-09 | — | — | EP | disclosed |
| EP-0602851-A1 | Quinazoline derivatives | ZENECA LIMITED (GB) | 1994-06-22 | — | — | EP | disclosed |