Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5AP | P20292 | 15/20 | 0.36 |
| ▸ | FEN1 | P39748 | 15/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12428289 | 0.86 | TP53 (0.38) | ALOX5APFEN1TP53NPC1PKM | |
| SCHEMBL4567622 | 0.85 | ALDH1A1 (0.37) | ALOX5APFEN1TP53PKMMAPT | |
| SCHEMBL13412031 | 0.75 | MAPK14 (0.37) | ALOX5APFEN1TP53PKMMAPT | |
| SCHEMBL12428085 | 0.75 | NPC1 (0.48) | ALOX5APFEN1TP53NPC1PKM | |
| SCHEMBL23110060 | 0.74 | KMT2A (0.50) | TP53NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL15834804 | 0.74 | ALDH1A1 (0.44) | ALOX5APFEN1 | |
| SCHEMBL172021 | 0.73 | PDE3B (0.41) | TP53SMN1; SMN2MEN1MAPTKMT2A | |
| SCHEMBL4427979 | 0.73 | PDE3B (0.41) | TP53SMN1; SMN2MEN1MAPTKMT2A | |
| SCHEMBL13239279 | 0.73 | ALDH1A1 (0.39) | ALOX5APFEN1 | |
| SCHEMBL13412045 | 0.73 | ALDH1A1 (0.39) | ALOX5APFEN1 |
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-2351741-A1 | PENTACYCLIC LIQUID CRYSTAL COMPOUND HAVING NITROGEN-CONTAINING HETEROCYCLIC RING, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT | Chisso Corporation (JP) | 2011-08-03 | — | — | EP | disclosed |