Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.51 |
| ▸ | EPHA2 | P29317 | 13/20 | 0.48 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.47 |
| ▸ | KDR | P35968 | 1/20 | 0.45 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.45 |
| ▸ | FBP1 | P09467 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28798391 | 0.86 | EGFR (0.57) | EGFREPHA2ABCG2KDREPHB4 | |
| SCHEMBL28798422 | 0.85 | EGFR (0.48) | EGFREPHA2ABCG2KDREPHB4 | |
| SCHEMBL28798373 | 0.83 | EPHA2 (0.46) | EGFREPHA2ABCG2KDREPHB4 | |
| SCHEMBL28798360 | 0.82 | EPHA2 (0.46) | EGFREPHA2ABCG2KDREPHB4 | |
| SCHEMBL28798383 | 0.81 | EGFR (0.46) | EGFREPHA2ABCG2KDREPHB4 | |
| SCHEMBL28829767 | 0.80 | EPHA2 (0.46) | EGFREPHA2KDREPHB4 | |
| SCHEMBL28829722 | 0.79 | HDAC3 (0.49) | EGFREPHA2KDREPHB4 | |
| SCHEMBL28829728 | 0.79 | HDAC3 (0.48) | EGFREPHA2KDR | |
| SCHEMBL28938282 | 0.77 | EPHA2 (0.46) | EPHA2 | |
| SCHEMBL28798339 | 0.76 | EGFR (0.52) | EGFRABCG2KDRFBP1 |
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 |