Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.73 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.73 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.73 |
| ▸ | TSHR | P16473 | 1/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.68 |
| ▸ | GAA | P10253 | 1/20 | 0.68 |
| ▸ | ACHE | P22303 | 10/20 | 0.67 |
| ▸ | BCHE | P06276 | 5/20 | 0.63 |
| ▸ | CA12 | O43570 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 1/20 | 0.56 |
| ▸ | CA4 | P22748 | 1/20 | 0.56 |
| ▸ | CA6 | P23280 | 1/20 | 0.56 |
| ▸ | CA7 | P43166 | 1/20 | 0.56 |
| ▸ | TPMT | P51580 | 1/20 | 0.56 |
| ▸ | CA9 | Q16790 | 1/20 | 0.56 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.56 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.54 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL9364577 | 0.88 | CYP1A2 (0.96) | CYP1A2CYP2C19CYP3A4CYP2C9TSHR | |
| SCHEMBL14194044 | 0.87 | CYP1A2 (0.54) | CYP1A2CYP2C19CYP3A4CYP2C9TSHR | |
| SCHEMBL15947113 | 0.87 | ALDH1A1 (0.78) | CYP1A2CYP2C19CYP3A4CYP2C9TSHR | |
| SCHEMBL16185983 | 0.86 | CYP1A2 (0.53) | CYP1A2CYP2C19CYP3A4CYP2C9TSHR | |
| SCHEMBL1493250 | 0.86 | CYP1A2 (1.00) | CYP1A2CYP2C19CYP3A4CYP2C9TSHR | |
| SCHEMBL12228744 | 0.82 | TSHR (0.71) | CYP1A2CYP2C19CYP3A4CYP2C9TSHR | |
| SCHEMBL30152416 | 0.81 | CYP1A2 (0.65) | CYP1A2CYP2C19CYP3A4CYP2C9TSHR | |
| SCHEMBL6872165 | 0.81 | TSHR (0.81) | CYP1A2CYP2C19CYP3A4CYP2C9TSHR | |
| SCHEMBL1333620 | 0.81 | CYP1A2 (0.81) | CYP1A2CYP2C19CYP3A4CYP2C9TSHR | |
| SCHEMBL4818731 | 0.81 | ALDH1A1 (1.00) | CYP1A2CYP2C19CYP3A4CYP2C9TSHR |
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-9139672-B2 | Polymerizable compound, liquid crystal composition, and liquid crystal display device | JNC CORPORATION (JP) | 2015-09-22 | — | — | US | disclosed |
| US-20140346399-A1 | POLYMERIZABLE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE | JNC PETROCHEMICAL CORPORATION (JP) | 2014-11-27 | — | — | US | disclosed |