Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 6/20 | 0.71 |
| ▸ | EGFR | P00533 | 11/20 | 0.63 |
| ▸ | KDR | P35968 | 7/20 | 0.63 |
| ▸ | RET | P07949 | 2/20 | 0.63 |
| ▸ | LCK | P06239 | 2/20 | 0.61 |
| ▸ | EPHA2 | P29317 | 3/20 | 0.61 |
| ▸ | EPHB4 | P54760 | 3/20 | 0.61 |
| ▸ | CLK1 | P49759 | 2/20 | 0.60 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.60 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.59 |
| ▸ | EPHB2 | P29323 | 1/20 | 0.59 |
| ▸ | FBP1 | P09467 | 2/20 | 0.58 |
| ▸ | AURKA | O14965 | 1/20 | 0.58 |
| ▸ | INSR | P06213 | 1/20 | 0.58 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.58 |
| ▸ | FLT4 | P35916 | 1/20 | 0.58 |
| ▸ | TEK | Q02763 | 1/20 | 0.58 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.58 |
| ▸ | KIF5B | P33176 | 1/20 | 0.58 |
| ▸ | GAK | O14976 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL8557888 | 0.83 | ERBB2 (1.00) | ERBB2EGFRKDRRETLCK | |
| SCHEMBL8096166 | 0.83 | EGFR (0.62) | ERBB2EGFR | |
| SCHEMBL8933754 | 0.81 | EGFR (0.80) | ERBB2EGFRKDRRETLCK | |
| SCHEMBL8556365 | 0.81 | ERBB2 (0.69) | ERBB2EGFRKDRRETLCK | |
| SCHEMBL8560764 | 0.81 | ERBB2 (0.72) | ERBB2EGFRKDRRETLCK | |
| SCHEMBL1387156 | 0.81 | EGFR (0.75) | ERBB2EGFRKDRRETLCK | |
| SCHEMBL8309598 | 0.80 | EGFR (0.65) | ERBB2EGFRKDRRETLCK | |
| Hydrochloric Acid SCHEMBL8810665 | 0.80 | EGFR (0.79) | ERBB2EGFRKDRRETLCK | |
| SCHEMBL18158179 | 0.80 | EGFR (0.79) | ERBB2EGFRKDRRETLCK | |
| Hydrochloric Acid SCHEMBL8811182 | 0.80 | EGFR (0.76) | ERBB2EGFRKDRRETLCK |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0843671-A1 | HETEROCYCLIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | GLAXO GROUP LIMITED (GB) | 1998-05-27 | — | — | EP | claimed |
| WO-1997003069-A1 | HETEROCYCLIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | GLAXO GROUP LIMITED (GB) | 1997-01-30 | — | — | WO | claimed |
| EP-0843671-A1 | HETEROCYCLIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | GLAXO GROUP LIMITED (GB) | 1998-05-27 | — | — | EP | disclosed |
| WO-1997003069-A1 | HETEROCYCLIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | GLAXO GROUP LIMITED (GB) | 1997-01-30 | — | — | WO | disclosed |