Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY6 | Q15077 | 1/20 | 0.46 |
| ▸ | THRA | P10827 | 2/20 | 0.42 |
| ▸ | THRB | P10828 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | RARB | P10826 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 2/20 | 0.39 |
| ▸ | MMP9 | P14780 | 2/20 | 0.39 |
| ▸ | MMP8 | P22894 | 2/20 | 0.39 |
| ▸ | MMP13 | P45452 | 2/20 | 0.39 |
| ▸ | TNNC1 | P63316 | 5/20 | 0.38 |
| ▸ | SGPL1 | O95470 | 1/20 | 0.38 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | GPR183 | P32249 | 1/20 | 0.38 |
| ▸ | CERS2 | Q96G23 | 1/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28916673 | 1.00 | P2RY6 (0.46) | P2RY6THRATHRBCYP3A4CYP2D6 | |
| SCHEMBL7652716 | 0.89 | P2RY6 (0.58) | P2RY6THRATHRBCYP3A4CYP2D6 | |
| SCHEMBL29305831 | 0.85 | HSD17B10 (0.54) | P2RY6CYP3A4CYP2D6CYP2C9RARB | |
| SCHEMBL29200032 | 0.85 | P2RY6 (0.59) | P2RY6CYP3A4CYP2D6CYP2C9TSHR | |
| SCHEMBL28582817 | 0.85 | PLK1 (0.39) | THRATHRBCYP3A4RARBTSHR | |
| SCHEMBL28582815 | 0.85 | PLK1 (0.39) | THRATHRBCYP3A4RARBTSHR | |
| SCHEMBL28588675 | 0.84 | RARB (0.38) | THRATHRBRARBTSHRHSD17B10 | |
| SCHEMBL28588678 | 0.84 | RARB (0.38) | THRATHRBRARBTSHRHSD17B10 | |
| SCHEMBL11856911 | 0.82 | P2RY6 (0.68) | P2RY6THRATHRBCYP3A4CYP2D6 | |
| SCHEMBL29305830 | 0.81 | P2RY6 (0.54) | P2RY6CYP3A4CYP2D6CYP2C9RARB |
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 |
|---|---|---|---|---|---|---|---|
| CN-109762576-B | Liquid crystal compound, liquid crystal composition and application thereof | 武汉轻工大学 | 2021-06-29 | — | — | CN | disclosed |
| CN-109762576-A | A kind of liquid-crystal compounds and liquid-crystal composition and its application | 武汉轻工大学 | 2019-05-17 | — | — | CN | disclosed |