Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 13/20 | 0.45 |
| ▸ | CTSS | P25774 | 3/20 | 0.37 |
| ▸ | CTSK | P43235 | 3/20 | 0.37 |
| ▸ | CTSB | P07858 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL18682936 | 1.00 | AAK1 (0.45) | AAK1CTSSCTSKCTSBPTGDR2 | |
| SCHEMBL18683054 | 0.85 | AAK1 (0.48) | AAK1CTSSCTSKPTGDR2NPC1 | |
| SCHEMBL18683332 | 0.84 | AAK1 (0.39) | AAK1CTSSCTSKCTSBPTGDR2 | |
| SCHEMBL21677279 | 0.84 | AAK1 (0.39) | AAK1CTSSCTSKCTSBPTGDR2 | |
| SCHEMBL18683330 | 0.84 | AAK1 (0.39) | AAK1CTSSCTSKCTSBPTGDR2 | |
| SCHEMBL21677301 | 0.84 | AAK1 (0.39) | AAK1CTSSCTSKCTSBPTGDR2 | |
| SCHEMBL27945123 | 0.83 | AAK1 (0.50) | AAK1CTSSCTSKPTGDR2NPC1 | |
| SCHEMBL253236 | 0.83 | AAK1 (0.50) | AAK1CTSSCTSKPTGDR2NPC1 | |
| SCHEMBL21677276 | 0.81 | AAK1 (0.42) | AAK1CTSSCTSKCTSBTRPA1 | |
| SCHEMBL18683317 | 0.81 | AAK1 (0.42) | AAK1CTSSCTSKCTSBTRPA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3353163-B1 | 2,3,4,5-TETRAHYDROPYRIDIN-6-AMINE DERIVATIVES | JANSSEN PHARMACEUTICA NV (BE) | 2020-02-05 | — | — | EP | disclosed |