Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 2/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.30 |
| ▸ | PPARA | Q07869 | 1/20 | 0.30 |
| ▸ | RARB | P10826 | 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 | |
|---|---|---|---|---|
| SCHEMBL15257976 | 0.92 | S1PR1 (0.34) | S1PR1RARB | |
| SCHEMBL10020173 | 0.88 | — | — | |
| SCHEMBL10020182 | 0.87 | CTSL (0.32) | — | |
| SCHEMBL10019530 | 0.87 | S1PR1 (0.34) | S1PR1RARB | |
| SCHEMBL10020130 | 0.86 | FAAH (0.32) | — | |
| SCHEMBL10020101 | 0.83 | — | — | |
| SCHEMBL15257984 | 0.82 | FAAH (0.33) | RARB | |
| SCHEMBL10020153 | 0.81 | S1PR1 (0.35) | S1PR1RARB | |
| SCHEMBL15257975 | 0.81 | CTSL (0.33) | — | |
| SCHEMBL15257978 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012086437-A1 | COMPOUND CONTAINING DIHYDROPHENANTHRENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY | JNC株式会社 (JP) | 2012-06-28 | — | — | WO | disclosed |