Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 12/20 | 0.77 |
| ▸ | EPHA2 | P29317 | 2/20 | 0.77 |
| ▸ | EPHB4 | P54760 | 2/20 | 0.77 |
| ▸ | SRC | P12931 | 3/20 | 0.64 |
| ▸ | MAPT | P10636 | 2/20 | 0.60 |
| ▸ | TP53 | P04637 | 1/20 | 0.60 |
| ▸ | EGFR | P00533 | 9/20 | 0.59 |
| ▸ | LCK | P06239 | 3/20 | 0.59 |
| ▸ | RET | P07949 | 2/20 | 0.57 |
| ▸ | AURKA | O14965 | 1/20 | 0.57 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | FYN | P06241 | 1/20 | 0.57 |
| ▸ | MET | P08581 | 1/20 | 0.57 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.57 |
| ▸ | LTK | P29376 | 1/20 | 0.57 |
| ▸ | TTK | P33981 | 1/20 | 0.57 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.57 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.57 |
| ▸ | BTK | Q06187 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL28726470 | 1.00 | KDR (0.77) | KDREPHA2EPHB4SRCMAPT | |
| SCHEMBL29624345 | 0.90 | KDR (0.62) | KDREPHA2EPHB4EGFRLCK | |
| SCHEMBL29624350 | 0.88 | KDR (0.61) | KDREPHA2EPHB4SRCEGFR | |
| SCHEMBL907676 | 0.87 | EPHA2 (1.00) | KDREPHA2EPHB4EGFR | |
| SCHEMBL28726468 | 0.81 | AURKB (0.71) | KDREGFRLCKRETAURKB | |
| SCHEMBL29624348 | 0.81 | AURKB (0.71) | KDREGFRLCKRETAURKB | |
| SCHEMBL6165322 | 0.81 | ABCG2 (0.61) | KDREPHA2EPHB4SRCMAPT | |
| SCHEMBL6165326 | 0.81 | ABCG2 (0.61) | KDREPHA2EPHB4SRCMAPT | |
| SCHEMBL28726465 | 0.81 | EGFR (0.66) | KDREGFRLCKRETGAK | |
| SCHEMBL29624346 | 0.81 | EGFR (0.66) | KDREGFRLCKRETGAK |
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-109336828-B | Quinazoline derivative and preparation method and application thereof | 雅安职业技术学院 | 2022-04-26 | — | — | CN | disclosed |