Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 18/20 | 0.80 |
| ▸ | KDR | P35968 | 6/20 | 0.59 |
| ▸ | FGFR1 | P11362 | 4/20 | 0.55 |
| ▸ | FLT1 | P17948 | 4/20 | 0.55 |
| ▸ | FLT4 | P35916 | 4/20 | 0.55 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.55 |
| ▸ | TEK | Q02763 | 2/20 | 0.55 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.55 |
| ▸ | PLK4 | O00444 | 1/20 | 0.55 |
| ▸ | CIT | O14578 | 1/20 | 0.55 |
| ▸ | GAK | O14976 | 1/20 | 0.55 |
| ▸ | EPHB6 | O15197 | 1/20 | 0.55 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.55 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.55 |
| ▸ | STK10 | O94804 | 1/20 | 0.55 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.55 |
| ▸ | ABL1 | P00519 | 1/20 | 0.55 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.55 |
| ▸ | LCK | P06239 | 1/20 | 0.55 |
| ▸ | FYN | P06241 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL21473608 | 0.89 | EGFR (1.00) | EGFRKDRFGFR1FLT1FLT4 | |
| SCHEMBL21475225 | 0.89 | EGFR (1.00) | EGFRKDRFGFR1FLT1FLT4 | |
| SCHEMBL21473662 | 0.89 | EGFR (1.00) | EGFRKDRFGFR1FLT1FLT4 | |
| SCHEMBL21473558 | 0.89 | EGFR (1.00) | EGFRKDRFGFR1FLT1FLT4 | |
| SCHEMBL21473564 | 0.87 | EGFR (0.80) | EGFRKDRFGFR1FLT1FLT4 | |
| SCHEMBL21473660 | 0.85 | EGFR (0.77) | EGFRKDRFGFR1FLT1FLT4 | |
| SCHEMBL21473606 | 0.85 | EGFR (0.91) | EGFRKDRFGFR1FLT1FLT4 | |
| SCHEMBL21473666 | 0.84 | EGFR (1.00) | EGFRKDRFGFR1FLT1FLT4 | |
| SCHEMBL21473571 | 0.84 | EGFR (0.76) | EGFRKDRFGFR1FLT1FLT4 | |
| SCHEMBL21473618 | 0.83 | EGFR (0.75) | EGFRKDRFGFR1FLT1FLT4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3778586-A1 | QUINAZOLINE COMPOUND SERVING AS EGFR TRIPLE MUTATION INHIBITOR AND APPLICATIONS THEREOF | East China University of Science and Technology (CN) | 2021-02-17 | — | — | EP | disclosed |