Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 10/20 | 0.66 |
| ▸ | KDR | P35968 | 6/20 | 0.65 |
| ▸ | SRC | P12931 | 1/20 | 0.65 |
| ▸ | ABCG2 | Q9UNQ0 | 4/20 | 0.63 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.63 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.61 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.61 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.61 |
| ▸ | KIT | P10721 | 1/20 | 0.60 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.58 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL6164812 | 1.00 | EGFR (0.66) | EGFRKDRSRCABCG2ABCB1 | |
| SCHEMBL6161899 | 0.91 | KDR (0.75) | EGFRKDRSRCABCG2ABCB1 | |
| SCHEMBL6163629 | 0.91 | KDR (0.75) | EGFRKDRSRCABCG2ABCB1 | |
| SCHEMBL6162938 | 0.91 | KDR (0.74) | EGFRKDRSRCABCG2ABCB1 | |
| SCHEMBL6166357 | 0.91 | KDR (0.70) | EGFRKDRABCG2ABCB1HDAC3 | |
| SCHEMBL6162947 | 0.91 | KDR (0.74) | EGFRKDRSRCABCG2ABCB1 | |
| SCHEMBL6163496 | 0.91 | KDR (0.70) | EGFRKDRABCG2ABCB1HDAC3 | |
| SCHEMBL6162922 | 0.86 | MEN1 (0.63) | EGFRKDRSRCABCG2ABCB1 | |
| SCHEMBL6166101 | 0.86 | MEN1 (0.63) | EGFRKDRSRCABCG2ABCB1 | |
| SCHEMBL6161476 | 0.86 | KDR (0.69) | EGFRKDRABCG2HDAC3HDAC1 |
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-1218357-B1 | QUINAZOLINE DERIVATIVES | ASTRAZENECA AB (SE) | 2005-04-06 | — | — | EP | claimed |