Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 6/20 | 0.82 |
| ▸ | KDR | P35968 | 16/20 | 0.81 |
| ▸ | KIT | P10721 | 1/20 | 0.72 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.68 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.68 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.68 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.68 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.68 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.68 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.68 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.68 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.68 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.68 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.68 |
| ▸ | AURKA | O14965 | 1/20 | 0.68 |
| ▸ | AURKB | Q96GD4 | 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 | |
|---|---|---|---|---|
| SCHEMBL31067733 | 0.91 | KDR (0.80) | EGFRKDRKIT | |
| SCHEMBL5478005 | 0.91 | EGFR (1.00) | EGFRKDRAURKAAURKB | |
| SCHEMBL31067640 | 0.90 | KDR (0.84) | EGFRKDRKITHDAC3HDAC4 | |
| SCHEMBL31067666 | 0.90 | KDR (1.00) | EGFRKDRKITAURKAAURKB | |
| SCHEMBL31067650 | 0.90 | KDR (0.83) | EGFRKDRKITAURKAAURKB | |
| Hydrochloric Acid SCHEMBL29623261 | 0.89 | EGFR (1.00) | EGFRKDRAURKAAURKB | |
| Hydrochloric Acid SCHEMBL5471121 | 0.89 | EGFR (1.00) | EGFRKDRAURKAAURKB | |
| SCHEMBL31067633 | 0.89 | KDR (0.82) | EGFRKDRKITHDAC3HDAC4 | |
| SCHEMBL31067708 | 0.89 | KDR (0.82) | EGFRKDRKITAURKAAURKB | |
| SCHEMBL31067670 | 0.88 | KDR (0.84) | EGFRKDRKITAURKAAURKB |
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 |