Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 8/20 | 0.77 |
| ▸ | ABCG2 | Q9UNQ0 | 5/20 | 0.77 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.77 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.77 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.77 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.77 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.77 |
| ▸ | ABL1 | P00519 | 1/20 | 0.77 |
| ▸ | PIM1 | P11309 | 1/20 | 0.77 |
| ▸ | PRKACA | P17612 | 1/20 | 0.77 |
| ▸ | LTK | P29376 | 1/20 | 0.77 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.77 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.77 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.77 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.77 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.77 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.77 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.77 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.77 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.77 |
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 | |
|---|---|---|---|---|
| SCHEMBL29941271 | 0.87 | EGFR (1.00) | EGFRABCG2ERBB2AURKBCLK4 | |
| SCHEMBL8920 | 0.87 | EGFR (1.00) | EGFRABCG2ERBB2AURKBCLK4 | |
| Hydrochloric Acid SCHEMBL20856873 | 0.86 | EGFR (0.96) | EGFRABCG2ERBB2AURKBCLK4 | |
| Hydrochloric Acid SCHEMBL29394578 | 0.86 | EGFR (0.96) | EGFRABCG2ERBB2AURKBCLK4 | |
| SCHEMBL8976752 | 0.83 | EGFR (0.78) | EGFRABCG2ERBB2AURKBCLK4 | |
| SCHEMBL31375768 | 0.83 | EGFR (0.65) | EGFRABCG2ERBB2AURKBCLK4 | |
| Hydrochloric Acid SCHEMBL8808235 | 0.83 | EGFR (0.90) | EGFRABCG2ERBB2AURKBCLK4 | |
| SCHEMBL6823152 | 0.82 | EGFR (0.71) | EGFRABCG2ERBB2AURKBCLK4 | |
| SCHEMBL14027230 | 0.81 | EGFR (0.75) | EGFRABCG2ERBB2AURKBCLK4 | |
| SCHEMBL5569041 | 0.81 | EGFR (0.75) | EGFRABCG2ERBB2AURKBCLK4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023081800-A1 | ALPHA-2A ADRENERGIC RECEPTOR MODULATORS AND USES THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2023-05-11 | — | — | WO | disclosed |
| WO-2004056812-A1 | 4- (PYRIDIN-4-YLAMINO) -QUINAZOLINE DERIVATIVES AS ANTI-TUMOR AGENTS | ASTRAZENECA AB (SE) | 2004-07-08 | — | — | WO | disclosed |