Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 8/20 | 0.48 |
| ▸ | PGR | P06401 | 2/20 | 0.48 |
| ▸ | SCN9A | Q15858 | 5/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.40 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27897141 | 0.84 | RORB (0.45) | ARPGRSCN9A | |
| SCHEMBL27842339 | 0.80 | CHRM2 (0.44) | — | |
| SCHEMBL26375398 | 0.79 | S1PR1 (0.55) | ARPGRSCN9AS1PR1 | |
| SCHEMBL28232101 | 0.78 | KIF11 (0.60) | ARPGRS1PR1TAS2R14KIF11 | |
| SCHEMBL4565768 | 0.77 | AKR1C3 (0.43) | SCN9AKIF11 | |
| SCHEMBL29177334 | 0.77 | ESR2 (0.45) | SCN9A | |
| SCHEMBL20573245 | 0.77 | RORB (0.51) | SCN9ABACE1KIF11 | |
| SCHEMBL7647143 | 0.75 | LMNA (0.50) | KIF11 | |
| SCHEMBL26373476 | 0.75 | AR (0.58) | ARSCN9AS1PR1BACE1 | |
| SCHEMBL17797024 | 0.75 | CNR2 (0.44) | SCN9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-108368060-A | A kind of novel pyridine derivatives kinase inhibitor | 中国科学院合肥物质科学研究院 | 2018-08-03 | — | — | CN | disclosed |