Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.40 |
| ▸ | APP | P05067 | 2/20 | 0.38 |
| ▸ | RARB | P10826 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SPHK1 | Q9NYA1 | 5/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | FASN | P49327 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | RORA | P35398 | 1/20 | 0.34 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7912781 | 1.00 | CYP3A4 (0.40) | CYP3A4CYP2C9APPRARBMAPT | |
| SCHEMBL7910989 | 1.00 | CYP3A4 (0.40) | CYP3A4CYP2C9APPRARBMAPT | |
| SCHEMBL7910986 | 1.00 | CYP3A4 (0.40) | CYP3A4CYP2C9APPRARBMAPT | |
| SCHEMBL7902493 | 0.96 | CYP3A4 (0.41) | CYP3A4CYP2C9APPRARBMAPT | |
| SCHEMBL7902495 | 0.96 | CYP3A4 (0.41) | CYP3A4CYP2C9APPRARBMAPT | |
| SCHEMBL7915936 | 0.96 | CYP3A4 (0.41) | CYP3A4CYP2C9APPRARBMAPT | |
| SCHEMBL7915939 | 0.96 | CYP3A4 (0.41) | CYP3A4CYP2C9APPRARBMAPT | |
| SCHEMBL7910900 | 0.95 | CYP2C9 (0.41) | CYP3A4CYP2C9APPRARBMAPT | |
| SCHEMBL7910897 | 0.95 | CYP2C9 (0.41) | CYP3A4CYP2C9APPRARBMAPT | |
| SCHEMBL10659185 | 0.95 | CYP3A4 (0.43) | CYP3A4CYP2C9APPRARBMAPT |
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 |