Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 7/20 | 0.33 |
| ▸ | ESR1 | P03372 | 6/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.30 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.30 |
| ▸ | HAO1 | Q9UJM8 | 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 | |
|---|---|---|---|---|
| SCHEMBL8041062 | 0.89 | ESR2 (0.33) | ESR2ESR1CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL8029366 | 0.89 | FASN (0.31) | ESR2ESR1CYP3A4CYP2C9 | |
| SCHEMBL8046272 | 0.87 | GABRP (0.34) | ESR2ESR1CYP3A4CYP2C9EGLN1 | |
| SCHEMBL8046293 | 0.86 | FFAR1 (0.34) | ESR2ESR1CYP3A4CYP2C9 | |
| SCHEMBL8042857 | 0.85 | SPHK1 (0.31) | ESR2ESR1CYP3A4CYP2C9 | |
| SCHEMBL8045708 | 0.84 | FFAR1 (0.41) | ESR2ESR1CYP3A4CYP2C9HAO1 | |
| SCHEMBL8046322 | 0.82 | FFAR1 (0.37) | CYP2C9 | |
| SCHEMBL8039315 | 0.80 | SPHK1 (0.36) | — | |
| SCHEMBL8040935 | 0.79 | ACACB (0.36) | ESR2ESR1CYP3A4CYP2C9HAO1 | |
| SCHEMBL8029234 | 0.78 | GABRP (0.31) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0727473-B1 | Liquid crystaline alkynyltolan compound, liquid crystal composition and liquid crystal display element | CHISSO CORP (JP) | 2000-01-12 | — | — | EP | disclosed |
| US-5833879-A | LOW TEMPERATURE MISCIBILITY AND COMPATIBILITY WITH OTHER LIQUID CRYSTAL COMPOUNDS; DISPLAYS CONTAINING MIXTURES OF AT LEAST TWO COMPOUNDS, PHYSICAL PROPERTIES | CHISSO CORPORATION (JP) | 1998-11-10 | — | — | US | disclosed |
| EP-0727473-A2 | Liquid crystaline alkynyltolan compound, liquid crystal composition and liquid crystal display element | Chisso Corporation (JP) | 1996-08-21 | — | — | EP | disclosed |