Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 2/20 | 0.36 |
| ▸ | RARA | P10276 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | ACACB | O00763 | 1/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | PPARD | Q03181 | 2/20 | 0.31 |
| ▸ | PPARA | Q07869 | 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 | |
|---|---|---|---|---|
| SCHEMBL20005267 | 0.83 | RARA (0.39) | RARBRARAHRH3ACACBMCHR1 | |
| SCHEMBL20004894 | 0.83 | RARA (0.39) | RARBRARAHRH3ACACBMCHR1 | |
| SCHEMBL20004816 | 0.83 | S1PR1 (0.36) | RARBRARAS1PR1HRH3ACACB | |
| SCHEMBL20005235 | 0.83 | S1PR1 (0.36) | RARBRARAS1PR1HRH3ACACB | |
| SCHEMBL20005207 | 0.82 | RARB (0.37) | RARBRARAS1PR1AAK1ACACB | |
| SCHEMBL19999533 | 0.80 | FFAR1 (0.33) | AAK1KDM1A | |
| SCHEMBL20005210 | 0.79 | ACACB (0.42) | ACACBMCHR1 | |
| SCHEMBL19999436 | 0.78 | RARB (0.39) | RARBRARAS1PR1ACACBMCHR1 | |
| SCHEMBL19999450 | 0.78 | S1PR1 (0.40) | RARBRARAS1PR1ACACBMCHR1 | |
| SCHEMBL20004813 | 0.78 | CYP2D6 (0.43) | RARBRARAACACBMCHR1CYP3A4 |
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-3299439-A1 | LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC Corporation (JP) | 2018-03-28 | — | — | EP | disclosed |