Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 16/20 | 0.75 |
| ▸ | ERBB2 | P04626 | 13/20 | 0.75 |
| ▸ | ERBB4 | Q15303 | 2/20 | 0.67 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.67 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.67 |
| ▸ | ROS1 | P08922 | 1/20 | 0.67 |
| ▸ | FLT3 | P36888 | 1/20 | 0.67 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.67 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.67 |
| ▸ | TTBK1 | Q5TCY1 | 1/20 | 0.54 |
| ▸ | TTBK2 | Q6IQ55 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8810261 | 0.99 | EGFR (0.74) | EGFRERBB2ERBB4AURKBCHEK2 | |
| Hydrochloric Acid SCHEMBL8811372 | 0.91 | EGFR (0.65) | EGFRERBB2ERBB4AURKBCHEK2 | |
| SCHEMBL5144877 | 0.89 | EGFR (0.70) | EGFRERBB2CLK4 | |
| SCHEMBL8809158 | 0.89 | EGFR (0.67) | EGFRERBB2ERBB4AURKBCHEK2 | |
| SCHEMBL8154615 | 0.88 | EGFR (0.77) | EGFRERBB2ERBB4AURKBCHEK2 | |
| SCHEMBL8807778 | 0.88 | EGFR (0.77) | EGFRERBB2ERBB4AURKBCHEK2 | |
| SCHEMBL1387244 | 0.86 | EGFR (1.00) | EGFRERBB2ERBB4AURKBCHEK2 | |
| Hydrochloric Acid SCHEMBL8808379 | 0.85 | EGFR (0.98) | EGFRERBB2ERBB4AURKBCHEK2 | |
| SCHEMBL8363497 | 0.85 | EGFR (1.00) | EGFRERBB2ERBB4AURKBCHEK2 | |
| SCHEMBL6663913 | 0.84 | EGFR (0.79) | EGFRERBB2ERBB4AURKBCHEK2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1999035132-A1 | HETEROCYCLIC COMPOUNDS | GLAXO GROUP LIMITED (GB) | 1999-07-15 | — | — | WO | disclosed |
| EP-0782570-A1 | SUBSTITUTED HETEROAROMATIC COMPOUNDS AND THEIR USE IN MEDICINE | THE WELLCOME FOUNDATION LIMITED (GB) | 1997-07-09 | — | — | EP | disclosed |
| WO-1996009294-A1 | SUBSTITUTED HETEROAROMATIC COMPOUNDS AND THEIR USE IN MEDICINE | THE WELLCOME FOUNDATION LIMITED (GB) | 1996-03-28 | — | — | WO | disclosed |