Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL4897020 | 0.84 | ADRA2B (0.38) | CYP1A2CYP3A4CYP2D6TSHRNFKB1 | |
| SCHEMBL4895866 | 0.83 | CYP1A2 (0.35) | CYP1A2CYP3A4CYP2D6TSHRNFKB1 | |
| SCHEMBL4897504 | 0.80 | KMT2A (0.34) | CYP1A2CYP3A4CYP2D6TSHRNFKB1 | |
| SCHEMBL464450 | 0.74 | — | — | |
| SCHEMBL28104483 | 0.72 | ALPG (0.44) | CYP1A2CYP3A4CYP2D6TSHRNFKB1 | |
| Hydrochloric Acid SCHEMBL20262982 | 0.72 | ALPG (0.46) | CYP1A2CYP3A4CYP2D6TSHRNFKB1 | |
| Bromide SCHEMBL28236460 | 0.72 | ALPG (0.44) | CYP1A2CYP3A4CYP2D6TSHRNFKB1 | |
| SCHEMBL14402534 | 0.72 | GABRA1 (0.41) | CYP1A2CYP3A4CYP2D6TSHRNFKB1 | |
| SCHEMBL17581662 | 0.71 | CYP1A2 (0.37) | CYP1A2CYP3A4CYP2D6TSHRNFKB1 | |
| SCHEMBL25043395 | 0.71 | — | — |
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-20080274305-A1 | Liquid Crystal Sealant and Liquid Crystal Display Cell Utilizing the Same | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 2008-11-06 | — | — | US | disclosed |
| EP-1780587-A1 | LIQUID CRYSTAL SEALANT AND LIQUID CRYSTAL DISPLAY CELL UTILIZING THE SAME | Nippon Kayaku Kabushiki Kaisha (JP) | 2007-05-02 | — | — | EP | disclosed |