Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 8/20 | 0.72 |
| ▸ | ERBB2 | P04626 | 6/20 | 0.72 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.63 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.56 |
| ▸ | MERTK | Q12866 | 4/20 | 0.53 |
| ▸ | ERBB4 | Q15303 | 2/20 | 0.52 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.52 |
| ▸ | ROS1 | P08922 | 1/20 | 0.52 |
| ▸ | FLT3 | P36888 | 1/20 | 0.52 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.52 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.52 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
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 SCHEMBL8889590 | 0.99 | EGFR (0.71) | EGFRERBB2NPY5RSLC2A1MERTK | |
| SCHEMBL8890861 | 0.89 | NPY5R (0.77) | EGFRERBB2NPY5RSLC2A1MERTK | |
| Hydrochloric Acid SCHEMBL8893122 | 0.89 | NPY5R (0.67) | EGFRERBB2NPY5RSLC2A1MERTK | |
| Hydrochloric Acid SCHEMBL8899212 | 0.88 | NPY5R (0.76) | EGFRERBB2NPY5RSLC2A1MERTK | |
| Hydrochloric Acid SCHEMBL8889878 | 0.87 | NPY5R (0.78) | EGFRNPY5RSLC2A1MERTKMAPT | |
| SCHEMBL8899542 | 0.86 | NPY5R (0.69) | EGFRERBB2NPY5RSLC2A1MERTK | |
| SCHEMBL8900305 | 0.86 | EGFR (0.69) | EGFRERBB2NPY5RSLC2A1MERTK | |
| Hydrochloric Acid SCHEMBL8890550 | 0.85 | NPY5R (0.67) | EGFRERBB2NPY5RSLC2A1MERTK | |
| Hydrochloric Acid SCHEMBL8899588 | 0.85 | CHEK2 (0.67) | EGFRERBB2NPY5RSLC2A1MERTK | |
| SCHEMBL1387244 | 0.84 | EGFR (1.00) | EGFRERBB2ERBB4CHEK2ROS1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997020822-A1 | QUINAZOLIN-2,4-DIAZIRINES AS NPY RECEPTOR ANTAGONIST | NOVARTIS AG (CH) | 1997-06-12 | — | — | WO | claimed |