Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 6/20 | 0.48 |
| ▸ | RARB | P10826 | 4/20 | 0.44 |
| ▸ | RARA | P10276 | 2/20 | 0.44 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.39 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.39 |
| ▸ | RARG | P13631 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14765992 | 0.98 | S1PR1 (0.46) | S1PR1RARBRARAS1PR3FAAH | |
| SCHEMBL14766002 | 0.96 | S1PR1 (0.44) | S1PR1RARBRARAS1PR3FAAH | |
| SCHEMBL12735656 | 0.93 | S1PR1 (0.47) | S1PR1RARBRARAS1PR3SMN1; SMN2 | |
| SCHEMBL14766003 | 0.92 | S1PR1 (0.43) | S1PR1RARBRARAS1PR3FAAH | |
| SCHEMBL14765991 | 0.92 | S1PR1 (0.43) | S1PR1RARBRARAS1PR3FAAH | |
| SCHEMBL14766029 | 0.90 | CYP3A4 (0.40) | S1PR1S1PR3CYP3A4SMN1; SMN2MEN1 | |
| SCHEMBL14766518 | 0.90 | CYP3A4 (0.40) | S1PR1S1PR3CYP3A4SMN1; SMN2MEN1 | |
| SCHEMBL12735657 | 0.89 | S1PR1 (0.44) | S1PR1RARBRARAS1PR3MEN1 | |
| SCHEMBL14766297 | 0.89 | FFAR1 (0.42) | S1PR1MEN1KMT2AFFAR1FFAR4 | |
| SCHEMBL14766902 | 0.89 | S1PR1 (0.45) | S1PR1RARBRARAS1PR3FAAH |
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 |