Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 2/20 | 0.38 |
| ▸ | NAAA | Q02083 | 2/20 | 0.34 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.32 |
| ▸ | CDK9 | P50750 | 2/20 | 0.32 |
| ▸ | RARB | P10826 | 3/20 | 0.32 |
| ▸ | RARA | P10276 | 2/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
| ▸ | RARG | P13631 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14766656 | 0.97 | S1PR1 (0.38) | S1PR1NAAACCNT1CDK9RARB | |
| SCHEMBL14766715 | 0.94 | NAAA (0.39) | S1PR1NAAACCNT1CDK9RARB | |
| SCHEMBL14766719 | 0.92 | S1PR1 (0.35) | S1PR1NAAACCNT1CDK9GABRA1 | |
| SCHEMBL14766291 | 0.92 | S1PR1 (0.35) | S1PR1NAAACCNT1CDK9GABRA1 | |
| SCHEMBL14766981 | 0.91 | CCNT1 (0.33) | CCNT1CDK9GABRA1GABRB2 | |
| SCHEMBL14766198 | 0.90 | NAAA (0.41) | S1PR1NAAACCNT1CDK9 | |
| SCHEMBL12738717 | 0.89 | S1PR1 (0.39) | S1PR1NAAACCNT1CDK9RARB | |
| SCHEMBL14766771 | 0.88 | CCNT1 (0.33) | CCNT1CDK9GABRA1GABRB2CNR2 | |
| SCHEMBL14766804 | 0.87 | S1PR1 (0.40) | S1PR1CCNT1CDK9RARBRARA | |
| SCHEMBL12738715 | 0.86 | S1PR1 (0.37) | S1PR1NAAACCNT1CDK9RARB |
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 |
|---|---|---|---|---|---|---|---|
| US-8394294-B2 | Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device | JNC CORPORATION (JP) | 2013-03-12 | — | — | US | disclosed |