Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | APP | P05067 | 2/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | FASN | P49327 | 1/20 | 0.32 |
| ▸ | RORC | P51449 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 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 | |
|---|---|---|---|---|
| SCHEMBL7912333 | 1.00 | CYP3A4 (0.36) | CYP3A4CYP2C9APPESR2CYP2D6 | |
| SCHEMBL12975706 | 0.86 | CYP2C9 (0.41) | CYP3A4CYP2C9APPESR2CYP2D6 | |
| SCHEMBL7910109 | 0.86 | ESR2 (0.37) | CYP3A4CYP2C9ESR2CYP2D6ESR1 | |
| SCHEMBL7910103 | 0.86 | ESR2 (0.37) | CYP3A4CYP2C9ESR2CYP2D6ESR1 | |
| SCHEMBL7915939 | 0.85 | CYP3A4 (0.41) | CYP3A4CYP2C9APPESR2CYP2D6 | |
| SCHEMBL7912977 | 0.85 | FASN (0.43) | CYP3A4CYP2C9APPESR2CYP2D6 | |
| SCHEMBL7902493 | 0.85 | CYP3A4 (0.41) | CYP3A4CYP2C9APPESR2CYP2D6 | |
| SCHEMBL7912974 | 0.85 | FASN (0.43) | CYP3A4CYP2C9APPESR2CYP2D6 | |
| SCHEMBL7915936 | 0.85 | CYP3A4 (0.41) | CYP3A4CYP2C9APPESR2CYP2D6 | |
| SCHEMBL7902495 | 0.85 | CYP3A4 (0.41) | CYP3A4CYP2C9APPESR2CYP2D6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6174456-B1 | STABILITY, LOW VISCOSITY AND HIGH TRANSITION TEMPERATURE OF THE ISOTROPIC PHASE | CHISSO CORPORATION (JP) | 2001-01-16 | — | — | US | disclosed |
| EP-0857708-A1 | LIQUID CRYSTAL COMPOUNDS HAVING SUBSTITUTED ALKYL GROUPS, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT | CHISSO CORPORATION (JP) | 1998-08-12 | — | — | EP | disclosed |