Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | APP | P05067 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | FASN | P49327 | 1/20 | 0.32 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.30 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.30 |
| ▸ | PDK2 | Q15119 | 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 | |
|---|---|---|---|---|
| SCHEMBL8959302 | 0.87 | CYP3A4 (0.34) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL9018578 | 0.86 | CYP3A4 (0.36) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL13263292 | 0.85 | WDR5 (0.31) | — | |
| SCHEMBL16521133 | 0.85 | CYP3A4 (0.33) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL9018752 | 0.84 | CYP3A4 (0.32) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL8959329 | 0.84 | CYP3A4 (0.33) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL8959306 | 0.84 | FASN (0.36) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL8933322 | 0.83 | CYP3A4 (0.36) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL8959330 | 0.82 | KDM1A (0.37) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL8959307 | 0.82 | FASN (0.33) | CYP3A4CYP2C9APPCYP2D6CYP2C19 |
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-2206695-A1 | TETRA- OR PENTA-CYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT | Chisso Corporation (JP) | 2010-07-14 | — | — | EP | disclosed |