Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 4/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.47 |
| ▸ | GLRA3 | O75311 | 1/20 | 0.42 |
| ▸ | GLRB | P48167 | 1/20 | 0.42 |
| ▸ | HSPA5 | P11021 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | BLM | P54132 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HMGCR | P04035 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL283522 | 0.82 | CYP1A2 (0.52) | CYP2C9CYP2C19CYP1A2GLRA3GLRB | |
| SCHEMBL14791819 | 0.81 | CYP1A2 (0.50) | CYP2C9CYP2C19CYP1A2GLRA3GLRB | |
| SCHEMBL8747642 | 0.81 | CYP1A2 (0.50) | CYP2C9CYP2C19CYP1A2GLRA3GLRB | |
| SCHEMBL9556746 | 0.79 | CYP1A2 (0.49) | CYP2C9CYP2C19CYP1A2GLRA3GLRB | |
| SCHEMBL8994600 | 0.79 | CYP1A2 (0.49) | CYP2C9CYP2C19CYP1A2GLRA3GLRB | |
| SCHEMBL29104736 | 0.79 | CYP1A2 (0.49) | CYP2C9CYP2C19CYP1A2GLRA3GLRB | |
| SCHEMBL4815659 | 0.77 | CYP1A2 (0.46) | CYP2C9CYP2C19CYP1A2GLRA3GLRB | |
| SCHEMBL8336608 | 0.77 | CYP1A2 (0.46) | CYP2C9CYP2C19CYP1A2GLRA3GLRB | |
| SCHEMBL10004784 | 0.76 | CYP1A2 (0.40) | CYP2C9CYP2C19CYP1A2ALDH1A1HIF1A | |
| SCHEMBL8608398 | 0.76 | GAA (0.43) | CYP2C9CYP2C19CYP1A2ALDH1A1HIF1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020196080-A1 | POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL CURED FILM, ELLIPTICALLY POLARIZING PLATE, AND ORGANIC EL DISPLAY DEVICE | 住友化学株式会社 | 2020-10-01 | — | — | WO | disclosed |