Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.45 |
| ▸ | RARB | P10826 | 8/20 | 0.44 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.44 |
| ▸ | CTRC | Q99895 | 1/20 | 0.41 |
| ▸ | RARA | P10276 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | RARG | P13631 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL35985 | 0.82 | RARB (0.50) | KCNH2RARBRARAMEN1ALDH1A1 | |
| SCHEMBL16572248 | 0.81 | RARB (0.57) | RARBRARAMEN1ALDH1A1MAPT | |
| SCHEMBL4716336 | 0.81 | RARB (0.57) | RARBRARAMEN1ALDH1A1MAPT | |
| SCHEMBL13618274 | 0.80 | RARB (0.58) | RARBRARAMEN1ALDH1A1MAPT | |
| SCHEMBL13617779 | 0.80 | RARB (0.58) | RARBRARAMEN1ALDH1A1MAPT | |
| SCHEMBL13454809 | 0.80 | XDH (0.48) | KCNH2RARBCTRC | |
| SCHEMBL847304 | 0.80 | ALDH1A1 (0.53) | RARBMEN1ALDH1A1MAPTKMT2A | |
| SCHEMBL177373 | 0.78 | ESR1 (0.57) | MEN1ALDH1A1KMT2AHSD17B10 | |
| SCHEMBL2120077 | 0.78 | ESR1 (0.57) | MEN1ALDH1A1KMT2AHSD17B10 | |
| SCHEMBL9026740 | 0.78 | ESR1 (0.57) | MEN1ALDH1A1KMT2AHSD17B10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4708441-A | LIQUID CRYSTALS | HOFFMAN-LA ROCHE INC. (US) | 1987-11-24 | — | — | US | disclosed |
| US-4550981-A | Liquid crystalline esters and mixtures | HOFFMANN-LA ROCHE INC. (US) | 1985-11-05 | — | — | US | disclosed |