Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 9/20 | 0.52 |
| ▸ | ERBB2 | P04626 | 8/20 | 0.52 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.51 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.51 |
| ▸ | FYN | P06241 | 2/20 | 0.47 |
| ▸ | SRC | P12931 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | RAF1 | P04049 | 1/20 | 0.46 |
| ▸ | BRAF | P15056 | 1/20 | 0.46 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.46 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.46 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.46 |
| ▸ | ROS1 | P08922 | 1/20 | 0.46 |
| ▸ | FLT3 | P36888 | 1/20 | 0.46 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.46 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.46 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.45 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5548967 | 1.00 | EGFR (0.52) | EGFRERBB2PIK3CGPIK3CAFYN | |
| SCHEMBL5552576 | 0.88 | EGFR (0.70) | EGFRERBB2AURKBCLK4CHEK2 | |
| SCHEMBL5552571 | 0.88 | EGFR (0.70) | EGFRERBB2AURKBCLK4CHEK2 | |
| SCHEMBL5554493 | 0.86 | KDR (0.60) | EGFRERBB2FYNSRCKDM4E | |
| SCHEMBL5554489 | 0.86 | KDR (0.60) | EGFRERBB2FYNSRCKDM4E | |
| SCHEMBL5549524 | 0.80 | ERBB2 (0.70) | EGFRERBB2ERBB4 | |
| SCHEMBL5549531 | 0.80 | ERBB2 (0.70) | EGFRERBB2ERBB4 | |
| SCHEMBL5553332 | 0.79 | ERBB2 (0.65) | EGFRERBB2MAPK1RAF1ERBB4 | |
| SCHEMBL5553328 | 0.79 | ERBB2 (0.65) | EGFRERBB2MAPK1RAF1ERBB4 | |
| SCHEMBL30819688 | 0.79 | EGFR (0.59) | EGFRRAF1BRAFABCG2 |
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-1147093-B1 | SUBSTITUTED BICYCLIC DERIVATIVES USEFUL AS ANTICANCER AGENTS | PFIZER PROD INC (US) | 2007-04-11 | — | — | EP | disclosed |