Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 9/20 | 0.38 |
| ▸ | ESR1 | P03372 | 6/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL11134889 | 0.95 | ESR2 (0.35) | ESR2ESR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL11134892 | 0.95 | ESR2 (0.35) | ESR2ESR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL7737232 | 0.95 | ESR2 (0.41) | ESR2ESR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL10904852 | 0.92 | ESR2 (0.43) | ESR2ESR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL10935701 | 0.92 | ESR2 (0.43) | ESR2ESR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL10904854 | 0.92 | ESR2 (0.43) | ESR2ESR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL10935693 | 0.92 | ESR2 (0.43) | ESR2ESR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL10935713 | 0.92 | ESR2 (0.43) | ESR2ESR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL10904861 | 0.92 | ESR2 (0.43) | ESR2ESR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL10904855 | 0.92 | ESR2 (0.43) | ESR2ESR1CYP2C9CYP3A4CYP2D6 |
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-0099099-B1 | HIGH TEMPERATURE LIQUID CRYSTAL SUBSTANCES HAVING FOUR RINGS AND LIQUID CRYSTAL COMPOSITIONS CONTAINING THE SAME | Chisso Corporation (JP) | 1987-04-08 | — | — | EP | disclosed |
| US-4472293-A | High temperature liquid crystal substances of four rings and liquid crystal compositions containing the same | CHISSO CORPORATION (JP) | 1984-09-18 | — | — | US | disclosed |
| EP-0099099-A2 | High temperature liquid crystal substances having four rings and liquid crystal compositions containing the same | Chisso Corporation (JP) | 1984-01-25 | — | — | EP | disclosed |