Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL5368752 | 0.77 | ALDH1A1 (0.35) | ALDH1A1TSHRHIF1A | |
| SCHEMBL18762473 | 0.76 | — | — | |
| SCHEMBL14615324 | 0.71 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL1031419 | 0.70 | — | — | |
| SCHEMBL21404111 | 0.70 | — | — | |
| SCHEMBL269537 | 0.69 | — | — | |
| SCHEMBL29109059 | 0.67 | — | — | |
| SCHEMBL12966455 | 0.67 | — | — | |
| SCHEMBL29225971 | 0.67 | — | — | |
| SCHEMBL29242557 | 0.67 | — | — |
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-2562234-A2 | Liquid crystal compound having perfluoroalkyl chain, liquid crystal composition and liquid crystal display device | JNC Corporation (JP) | 2013-02-27 | — | — | EP | disclosed |