Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 17/20 | 0.83 |
| ▸ | EGFR | P00533 | 4/20 | 0.77 |
| ▸ | KIT | P10721 | 1/20 | 0.74 |
| ▸ | AURKA | O14965 | 1/20 | 0.69 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.69 |
| ▸ | BRAF | P15056 | 1/20 | 0.68 |
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 | |
|---|---|---|---|---|
| SCHEMBL31067640 | 0.91 | KDR (0.84) | KDREGFRKITAURKAAURKB | |
| SCHEMBL31067666 | 0.91 | KDR (1.00) | KDREGFRKITAURKAAURKB | |
| SCHEMBL31067630 | 0.90 | KDR (0.82) | KDREGFRKITAURKAAURKB | |
| SCHEMBL5473778 | 0.90 | EGFR (0.80) | KDREGFR | |
| SCHEMBL31067708 | 0.90 | KDR (0.82) | KDREGFRKITAURKAAURKB | |
| SCHEMBL31067633 | 0.90 | KDR (0.82) | KDREGFRKITAURKAAURKB | |
| SCHEMBL31067662 | 0.90 | EGFR (0.82) | KDREGFRKITAURKAAURKB | |
| Hydrochloric Acid SCHEMBL5473795 | 0.89 | EGFR (0.80) | KDREGFR | |
| SCHEMBL31067688 | 0.87 | KDR (0.80) | KDREGFRKITAURKAAURKB | |
| SCHEMBL31067670 | 0.87 | KDR (0.84) | KDREGFRKITAURKAAURKB |
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-118530175-A | PDGFR inhibitor and preparation method and application thereof | 中国药科大学 | 2024-08-23 | — | — | CN | disclosed |