Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.31 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.31 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.31 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15965525 | 1.00 | ALDH1A1 (0.33) | ALDH1A1TLR9TLR8TLR7TRPV3 | |
| SCHEMBL16488482 | 0.96 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL9763946 | 0.90 | TRPV3 (0.34) | ALDH1A1TRPV3 | |
| SCHEMBL8860603 | 0.90 | TRPV3 (0.34) | ALDH1A1TRPV3 | |
| SCHEMBL21626052 | 0.90 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL13636638 | 0.89 | ALDH1A1 (0.33) | ALDH1A1TLR9TLR8TLR7TRPV3 | |
| SCHEMBL15965526 | 0.88 | CYP2C9 (0.40) | ALDH1A1 | |
| SCHEMBL3152900 | 0.87 | TRPV3 (0.31) | TRPV3 | |
| SCHEMBL3152908 | 0.87 | TRPV3 (0.31) | TRPV3 | |
| SCHEMBL6454920 | 0.86 | — | — |
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-2703473-B1 | NEMATIC LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE USING SAME | DAINIPPON INK & CHEMICALS (JP) | 2016-09-21 | — | — | EP | disclosed |