Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 6/20 | 0.62 |
| ▸ | KDR | P35968 | 12/20 | 0.55 |
| ▸ | FLT1 | P17948 | 5/20 | 0.55 |
| ▸ | FLT4 | P35916 | 2/20 | 0.55 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.55 |
| ▸ | AURKA | O14965 | 1/20 | 0.55 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.55 |
| ▸ | INSR | P06213 | 1/20 | 0.55 |
| ▸ | FBP1 | P09467 | 1/20 | 0.55 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.55 |
| ▸ | CLK1 | P49759 | 1/20 | 0.55 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.55 |
| ▸ | TEK | Q02763 | 1/20 | 0.55 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.55 |
| ▸ | EPHB2 | P29323 | 1/20 | 0.55 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.54 |
| ▸ | SRC | P12931 | 2/20 | 0.53 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.53 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.53 |
| ▸ | RET | P07949 | 4/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL6046878 | 0.89 | KDR (0.56) | EGFRKDRFLT1FLT4FGFR1 | |
| SCHEMBL6046861 | 0.85 | EGFR (0.82) | EGFRKDRFLT1FLT4FGFR1 | |
| SCHEMBL3962043 | 0.84 | SRC (0.62) | EGFRKDRFLT1FLT4FGFR1 | |
| SCHEMBL3328655 | 0.82 | EGFR (0.82) | EGFRKDRFLT4AURKAERBB2 | |
| SCHEMBL14515605 | 0.82 | EGFR (0.69) | EGFRKDRFLT1FLT4AURKA | |
| SCHEMBL30968994 | 0.82 | EGFR (0.82) | EGFRKDRFLT4AURKAERBB2 | |
| Hydrochloric Acid SCHEMBL641764 | 0.82 | EGFR (0.80) | EGFRKDRFLT4AURKAERBB2 | |
| SCHEMBL17179601 | 0.82 | EGFR (0.68) | EGFRKDRFLT1FLT4FGFR1 | |
| SCHEMBL14843429 | 0.82 | EGFR (0.80) | EGFRKDRFLT1FLT4FGFR1 | |
| SCHEMBL13271747 | 0.82 | EGFR (0.73) | EGFRKDRERBB2SRCRET |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1633365-A1 | MACROCYCLIC QUINAZOLINE DERIVATIVES AS ANTIPROLIFERATIVE AGENTS | JANSSEN PHARMACEUTICA N.V. (BE) | 2006-03-15 | — | — | EP | disclosed |
| WO-2004105765-A1 | MACROCYCLIC QUINAZOLINE DERIVATIVES AS ANTIPROLIFERATIVE AGENTS | JANSSEN PHARMACEUTICA N.V. (BE) | 2004-12-09 | — | — | WO | disclosed |