Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 2/20 | 0.39 |
| ▸ | CNR2 | P34972 | 2/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.32 |
| ▸ | RARB | P10826 | 3/20 | 0.31 |
| ▸ | RARA | P10276 | 2/20 | 0.31 |
| ▸ | RARG | P13631 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | CYP17A1 | P05093 | 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 | |
|---|---|---|---|---|
| SCHEMBL14766638 | 0.91 | S1PR1 (0.33) | S1PR1CNR2CNR1GABRA1GABRB2 | |
| SCHEMBL14766948 | 0.91 | S1PR1 (0.42) | S1PR1CNR2CNR1RARBRARA | |
| SCHEMBL14766450 | 0.91 | S1PR1 (0.40) | S1PR1CNR2RARBRARARARG | |
| SCHEMBL12738916 | 0.89 | GRM2 (0.35) | S1PR1CNR2CNR1CYP17A1 | |
| SCHEMBL14766723 | 0.89 | CNR2 (0.39) | S1PR1CNR2CNR1GABRA1GABRB2 | |
| SCHEMBL14766003 | 0.89 | S1PR1 (0.43) | S1PR1CNR2CNR1GABRA1GABRB2 | |
| SCHEMBL14766449 | 0.88 | S1PR1 (0.41) | S1PR1CNR2CNR1GABRA1GABRB2 | |
| SCHEMBL12823620 | 0.86 | S1PR1 (0.35) | S1PR1CNR2CNR1GABRA1GABRB2 | |
| SCHEMBL14765991 | 0.86 | S1PR1 (0.43) | S1PR1CNR2CNR1GABRA1GABRB2 | |
| SCHEMBL12738897 | 0.85 | S1PR1 (0.43) | S1PR1CNR2CNR1RARBRARA |
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 |