Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | RARA | P10276 | 2/20 | 0.37 |
| ▸ | RARG | P13631 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.33 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | ACACA | Q13085 | 1/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL18310416 | 0.94 | RARB (0.40) | RARBNPC1RAB9ARARARARG | |
| SCHEMBL18310378 | 0.94 | RARB (0.40) | RARBNPC1RAB9ARARARARG | |
| SCHEMBL18310477 | 0.91 | RARB (0.37) | RARBNPC1RAB9ARARARARG | |
| SCHEMBL18310422 | 0.88 | NPC1 (0.32) | NPC1RAB9ATP53PKMSMN1; SMN2 | |
| SCHEMBL18310380 | 0.88 | NPC1 (0.32) | NPC1RAB9ATP53PKMSMN1; SMN2 | |
| SCHEMBL19829160 | 0.86 | RARB (0.30) | RARBNPC1RAB9ARARARARG | |
| SCHEMBL18310484 | 0.85 | ALOX5 (0.35) | RARBNPC1RAB9ATP53PKM | |
| SCHEMBL19829090 | 0.85 | RARB (0.48) | RARBNPC1RAB9ARARARARG | |
| SCHEMBL18310417 | 0.85 | CNR1 (0.33) | RARBNPC1RAB9ATP53PKM | |
| SCHEMBL18310409 | 0.84 | RARB (0.40) | RARBNPC1RAB9ARARARARG |
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 |