Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 8/20 | 0.40 |
| ▸ | ESR1 | P03372 | 6/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.35 |
| ▸ | HTR1A | P08908 | 2/20 | 0.33 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | DRD3 | P35462 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | DRD5 | P21918 | 1/20 | 0.33 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9479291 | 1.00 | ESR2 (0.40) | ESR2ESR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL9479295 | 1.00 | ESR2 (0.40) | ESR2ESR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL9479287 | 1.00 | ESR2 (0.40) | ESR2ESR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL9511519 | 0.95 | ESR2 (0.37) | ESR2ESR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL9477744 | 0.95 | ESR2 (0.41) | ESR2ESR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL9511502 | 0.95 | ESR2 (0.37) | ESR2ESR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL9477671 | 0.95 | ESR2 (0.37) | ESR2ESR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL9477765 | 0.95 | ESR2 (0.41) | ESR2ESR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL9477680 | 0.95 | ESR2 (0.37) | ESR2ESR1CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL9477761 | 0.95 | ESR2 (0.41) | 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-0377469-B1 | A LIQUID CRYSTALLINE COMPOUND | CHISSO CORPORATION (JP) | 1993-10-06 | — | — | EP | disclosed |
| US-5183587-A | LIQUID CRYSTALLINE COMPOUND | CHISSO CORPORATION (JP) | 1993-02-02 | — | — | US | disclosed |
| EP-0377469-A1 | A liquid crystalline compound | CHISSO CORPORATION (JP) | 1990-07-11 | — | — | EP | disclosed |