Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 18/20 | 0.44 |
| ▸ | KIT | P10721 | 1/20 | 0.42 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28428993 | 0.90 | EGFR (0.41) | EGFRKIT | |
| SCHEMBL29111064 | 0.89 | PDGFRA (0.42) | EGFRKIT | |
| SCHEMBL30646047 | 0.89 | PDGFRA (0.42) | EGFRKIT | |
| SCHEMBL28423290 | 0.86 | EGFR (0.43) | EGFR | |
| SCHEMBL30646063 | 0.86 | EGFR (0.43) | EGFR | |
| SCHEMBL28423107 | 0.74 | KDR (0.45) | EGFRKIT | |
| SCHEMBL30646060 | 0.74 | KDR (0.45) | EGFRKIT | |
| SCHEMBL29111046 | 0.73 | PDGFRA (0.43) | EGFRKIT | |
| SCHEMBL31467708 | 0.71 | PDPK1 (0.51) | EGFRKITPDPK1 | |
| SCHEMBL5017339 | 0.69 | CHEK2 (0.44) | — |
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-111253385-B | Heterocyclic compound, preparation method and application | 遵义医科大学珠海校区 | 2023-11-24 | — | — | CN | disclosed |