Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 7/20 | 0.56 |
| ▸ | KDR | P35968 | 5/20 | 0.50 |
| ▸ | EPHA2 | P29317 | 4/20 | 0.50 |
| ▸ | EPHB4 | P54760 | 2/20 | 0.50 |
| ▸ | RET | P07949 | 1/20 | 0.50 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.49 |
| ▸ | SRC | P12931 | 3/20 | 0.49 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.49 |
| ▸ | CLK1 | P49759 | 1/20 | 0.48 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.48 |
| ▸ | LCK | P06239 | 1/20 | 0.47 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29713885 | 0.86 | EGFR (0.49) | EGFRKDREPHA2EPHB4MAPK14 | |
| SCHEMBL28798364 | 0.86 | EGFR (0.49) | EGFRKDREPHA2EPHB4MAPK14 | |
| SCHEMBL28798336 | 0.84 | EGFR (0.59) | EGFRKDREPHA2EPHB4MAPK14 | |
| SCHEMBL28798349 | 0.83 | PDE10A (0.50) | EGFRKDREPHA2EPHB4RET | |
| SCHEMBL28950334 | 0.81 | EGFR (0.47) | EGFRKDREPHA2EPHB4MAPK14 | |
| SCHEMBL28798340 | 0.80 | PDE10A (0.47) | EGFRKDREPHA2EPHB4MAPK14 | |
| SCHEMBL28798405 | 0.80 | PDE10A (0.47) | EGFRKDREPHA2EPHB4MAPK14 | |
| SCHEMBL29713896 | 0.80 | PDE10A (0.47) | EGFRKDREPHA2EPHB4MAPK14 | |
| SCHEMBL161067 | 0.80 | EGFR (0.63) | EGFRKDRRETSRC | |
| SCHEMBL29713893 | 0.79 | EGFR (0.50) | EGFRKDREPHA2EPHB4RET |
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 |
|---|---|---|---|---|---|---|---|
| CN-114835683-A | Quinazoline-4, 6-diamine compound containing morpholinyl aromatic heterocycle and preparation method thereof | 江苏食品药品职业技术学院 | 2022-08-02 | — | — | CN | disclosed |