Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.44 |
| ▸ | RAB9A | P51151 | 5/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.39 |
| ▸ | FEN1 | P39748 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.36 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19829200 | 0.89 | S1PR1 (0.37) | ALOX5APFEN1GRM2S1PR1S1PR3 | |
| SCHEMBL12357725 | 0.87 | RAB9A (0.50) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL12357716 | 0.86 | RAB9A (0.46) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL12357681 | 0.85 | RAB9A (0.45) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL12357902 | 0.85 | RAB9A (0.45) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL19829110 | 0.85 | SMN1; SMN2 (0.47) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL19829176 | 0.84 | SMN1; SMN2 (0.44) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL2247245 | 0.84 | RAB9A (0.49) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL12357710 | 0.84 | RAB9A (0.49) | SMN1; SMN2RAB9ANPC1TP53PKM | |
| SCHEMBL12357713 | 0.83 | RAB9A (0.47) | SMN1; SMN2RAB9ANPC1TP53PKM |
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 |