Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 1/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 4/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | MPL | P40238 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18310555 | 0.88 | RARB (0.42) | RARBS1PR1S1PR3ALOX5GABRA1 | |
| SCHEMBL18310413 | 0.87 | ALOX5 (0.38) | RARBS1PR1S1PR3ALOX5CNR1 | |
| SCHEMBL18310571 | 0.87 | ALOX5 (0.38) | RARBS1PR1S1PR3ALOX5CNR1 | |
| SCHEMBL18310375 | 0.87 | CNR1 (0.37) | RARBS1PR1S1PR3ALOX5CNR1 | |
| SCHEMBL18310484 | 0.82 | ALOX5 (0.35) | RARBS1PR1S1PR3ALOX5CNR1 | |
| SCHEMBL18310417 | 0.82 | CNR1 (0.33) | RARBS1PR1S1PR3ALOX5CNR1 | |
| SCHEMBL18310483 | 0.82 | RARB (0.40) | RARBS1PR1S1PR3ALOX5CNR1 | |
| SCHEMBL18310409 | 0.82 | RARB (0.40) | RARBS1PR1S1PR3ALOX5CNR1 | |
| SCHEMBL18310478 | 0.81 | RARB (0.39) | RARBS1PR1S1PR3ALOX5NPC1 | |
| SCHEMBL14946062 | 0.80 | RARB (0.49) | RARBS1PR1S1PR3NPC1RAB9A |
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-20180030351-A1 | LIQUID CRYSTAL COMPOUND HAVING POLYFLUORO-2-BUTENOXY GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC CORPORATION (JP) | 2018-02-01 | — | — | US | disclosed |