Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 19/20 | 0.69 |
| ▸ | KDR | P35968 | 2/20 | 0.66 |
| ▸ | FBP1 | P09467 | 2/20 | 0.66 |
| ▸ | AURKA | O14965 | 1/20 | 0.66 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.66 |
| ▸ | INSR | P06213 | 1/20 | 0.66 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.66 |
| ▸ | FLT4 | P35916 | 1/20 | 0.66 |
| ▸ | CLK1 | P49759 | 1/20 | 0.66 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.66 |
| ▸ | TEK | Q02763 | 1/20 | 0.66 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.66 |
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 | |
|---|---|---|---|---|
| SCHEMBL13189303 | 0.90 | EGFR (0.70) | EGFRKDRFBP1AURKAERBB2 | |
| SCHEMBL7846579 | 0.86 | ERBB2 (0.61) | EGFRKDRFBP1AURKAERBB2 | |
| SCHEMBL7597263 | 0.83 | EGFR (0.54) | EGFRKDRFBP1AURKAERBB2 | |
| SCHEMBL29731422 | 0.82 | EGFR (0.98) | EGFRKDRERBB2FLT4EPHB4 | |
| SCHEMBL4222431 | 0.82 | EGFR (0.98) | EGFRKDRERBB2FLT4EPHB4 | |
| SCHEMBL30505605 | 0.81 | EGFR (1.00) | EGFRKDRFBP1AURKAERBB2 | |
| SCHEMBL2099106 | 0.81 | EGFR (1.00) | EGFRKDRFBP1AURKAERBB2 | |
| SCHEMBL13497856 | 0.81 | EGFR (0.85) | EGFRKDRFBP1AURKAERBB2 | |
| Hydrochloric Acid SCHEMBL27887194 | 0.80 | EGFR (0.98) | EGFRKDRFBP1AURKAERBB2 | |
| SCHEMBL22336753 | 0.80 | FBP1 (0.92) | EGFRKDRFBP1AURKAERBB2 |
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-1163227-A1 | BICYCLIC HETEROCYCLES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS, AND PROCESSES FOR PREPARING THEM | Boehringer Ingelheim Pharma KG (DE) | 2001-12-19 | — | — | EP | disclosed |
| WO-2000055141-A1 | BICYCLIC HETEROCYCLES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS, AND PROCESSES FOR PREPARING THEM | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2000-09-21 | — | — | WO | disclosed |