Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | APP | P05067 | 2/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | FASN | P49327 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.33 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.33 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.33 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.33 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.33 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.33 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL19820867 | 0.92 | FASN (0.41) | CYP3A4CYP2C9APPESR2CYP2D6 | |
| SCHEMBL19493506 | 0.91 | CYP3A4 (0.43) | CYP3A4CYP2C9APPESR2CYP2D6 | |
| SCHEMBL802781 | 0.91 | CYP3A4 (0.43) | CYP3A4CYP2C9APPESR2CYP2D6 | |
| SCHEMBL2741531 | 0.91 | FASN (0.47) | CYP3A4CYP2C9APPESR2CYP2D6 | |
| SCHEMBL91987 | 0.91 | FASN (0.47) | CYP3A4CYP2C9APPESR2CYP2D6 | |
| SCHEMBL19820861 | 0.91 | FASN (0.40) | CYP3A4CYP2C9APPESR2CYP2D6 | |
| SCHEMBL13408581 | 0.90 | FASN (0.46) | CYP3A4CYP2C9APPESR2CYP2D6 | |
| SCHEMBL12377041 | 0.89 | FASN (0.49) | CYP3A4CYP2C9APPESR2CYP2D6 | |
| SCHEMBL19820869 | 0.89 | FASN (0.39) | CYP3A4CYP2C9APPESR2CYP2D6 | |
| SCHEMBL19820868 | 0.88 | FASN (0.44) | 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-9587175-B2 | Nematic liquid crystal composition | DIC CORPORATION (JP) | 2017-03-07 | — | — | US | disclosed |
| US-20170045765-A1 | LCD DEVICE | DIC CORPORATION (JP) | 2017-02-16 | — | — | US | disclosed |