Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 6/20 | 0.43 |
| ▸ | PDE4A | P27815 | 5/20 | 0.39 |
| ▸ | KRAS | P01116 | 1/20 | 0.36 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 4/20 | 0.35 |
| ▸ | CNR2 | P34972 | 4/20 | 0.35 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | PDE2A | O00408 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16997376 | 0.90 | EGFR (0.41) | EGFRKRASSOS1CNR1CNR2 | |
| SCHEMBL9279868 | 0.89 | EGFR (0.38) | EGFRPDE4AKRASSOS1CNR1 | |
| SCHEMBL9729028 | 0.85 | EGFR (0.41) | EGFRPDE4AKRASSOS1CNR1 | |
| SCHEMBL9728970 | 0.84 | EGFR (0.40) | EGFRKRASSOS1CNR1CNR2 | |
| SCHEMBL8014129 | 0.83 | EGFR (0.43) | EGFRKRASSOS1P2RX3 | |
| SCHEMBL8024922 | 0.80 | EGFR (0.42) | EGFRKRASSOS1CNR1CNR2 | |
| SCHEMBL11099038 | 0.76 | EGFR (0.45) | EGFRKRASSOS1CNR1CNR2 | |
| SCHEMBL11102122 | 0.76 | CNR1 (0.47) | EGFRCNR1CNR2P2RX3 | |
| SCHEMBL8755978 | 0.75 | GALR3 (0.41) | EGFRKRASSOS1CNR1CNR2 | |
| SCHEMBL8025127 | 0.75 | EGFR (0.46) | EGFRKRASSOS1P2RX3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5141941-A | ARALKYLAMINE DERIVATIVES, AND FUNGICIDES CONTAINING THE SAME | UBE INDUSTRIES, LTD. (JP) | 1992-08-25 | — | — | US | claimed |