Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.51 |
| ▸ | AURKB | Q96GD4 | 10/20 | 0.45 |
| ▸ | RAF1 | P04049 | 1/20 | 0.45 |
| ▸ | BRAF | P15056 | 1/20 | 0.45 |
| ▸ | KIT | P10721 | 2/20 | 0.45 |
| ▸ | FLT3 | P36888 | 2/20 | 0.45 |
| ▸ | TDO2 | P48775 | 1/20 | 0.45 |
| ▸ | AURKA | O14965 | 1/20 | 0.45 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 2/20 | 0.42 |
| ▸ | MELK | Q14680 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL31514586 | 0.95 | EGFR (0.48) | EGFRAURKBRAF1BRAFKIT | |
| SCHEMBL31514594 | 0.89 | AURKB (0.49) | EGFRAURKBRAF1BRAFKIT | |
| SCHEMBL31514623 | 0.88 | CNR2 (0.52) | EGFRAURKBRAF1BRAFKIT | |
| SCHEMBL31514564 | 0.85 | TDO2 (0.48) | EGFRAURKBKITFLT3TDO2 | |
| SCHEMBL31514556 | 0.85 | FGFR1 (0.49) | EGFRAURKBRAF1BRAFKIT | |
| SCHEMBL31514621 | 0.85 | EGFR (0.50) | EGFRAURKBKITFLT3TDO2 | |
| SCHEMBL31514608 | 0.82 | DGAT1 (0.50) | EGFRAURKBBRAFTDO2MAP4K4 | |
| SCHEMBL31514561 | 0.82 | DGAT1 (0.50) | EGFRAURKBTDO2MAP4K4 | |
| SCHEMBL31514603 | 0.82 | EGFR (0.47) | EGFRAURKBBRAFKITFLT3 | |
| SCHEMBL31514585 | 0.80 | CD38 (0.48) | EGFRAURKBRAF1BRAFKIT |
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-119912429-A | Quinazoline compound with anti-inflammatory activity or pharmaceutically acceptable salt thereof, pharmaceutical composition and application thereof | 安徽医科大学 | 2025-05-02 | — | — | CN | disclosed |