Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 4/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL6666599 | 0.95 | ESR2 (0.38) | ESR2CYP2C9ESR1CYP3A4ALDH1A1 | |
| SCHEMBL6667625 | 0.91 | CYP2C9 (0.41) | ESR2CYP2C9ESR1CYP3A4ALDH1A1 | |
| SCHEMBL6665828 | 0.91 | ESR2 (0.35) | ESR2CYP2C9ESR1CYP3A4ALDH1A1 | |
| SCHEMBL6664944 | 0.91 | ESR2 (0.35) | ESR2CYP2C9ESR1CYP3A4ALDH1A1 | |
| SCHEMBL6661236 | 0.90 | ESR2 (0.34) | ESR2CYP2C9ESR1CYP3A4 | |
| SCHEMBL6663508 | 0.90 | IDO1 (0.40) | ESR2ALDH1A1LMNAMAPT | |
| SCHEMBL6664041 | 0.90 | ESR2 (0.34) | ESR2CYP2C9ESR1CYP3A4 | |
| SCHEMBL6667970 | 0.89 | ESR2 (0.33) | ESR2CYP2C9 | |
| SCHEMBL6664963 | 0.89 | ESR2 (0.33) | ESR2CYP2C9 | |
| SCHEMBL6667550 | 0.88 | SPHK1 (0.37) | ESR2CYP2C9ALDH1A1LMNAMAPT |
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-0893423-B1 | LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES | CHISSO CORP (JP) | 2004-09-01 | — | — | EP | disclosed |