Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 2/20 | 0.42 |
| ▸ | THRA | P10827 | 1/20 | 0.42 |
| ▸ | ITGB3 | P05106 | 3/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 3/20 | 0.39 |
| ▸ | CNR2 | P34972 | 4/20 | 0.39 |
| ▸ | CNR1 | P21554 | 3/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | RARB | P10826 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RARA | P10276 | 1/20 | 0.38 |
| ▸ | RARG | P13631 | 1/20 | 0.38 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.37 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9398367 | 1.00 | THRB (0.42) | THRBTHRAITGB3ITGA2BCNR2 | |
| SCHEMBL9398314 | 1.00 | THRB (0.42) | THRBTHRAITGB3ITGA2BCNR2 | |
| SCHEMBL9398334 | 1.00 | THRB (0.42) | THRBTHRAITGB3ITGA2BCNR2 | |
| SCHEMBL9398594 | 1.00 | THRB (0.42) | THRBTHRAITGB3ITGA2BCNR2 | |
| SCHEMBL9398302 | 1.00 | THRB (0.42) | THRBTHRAITGB3ITGA2BCNR2 | |
| SCHEMBL9398597 | 1.00 | THRB (0.42) | THRBTHRAITGB3ITGA2BCNR2 | |
| SCHEMBL9398285 | 1.00 | THRB (0.42) | THRBTHRAITGB3ITGA2BCNR2 | |
| SCHEMBL9398299 | 1.00 | THRB (0.42) | THRBTHRAITGB3ITGA2BCNR2 | |
| SCHEMBL9398290 | 1.00 | THRB (0.42) | THRBTHRAITGB3ITGA2BCNR2 | |
| SCHEMBL9398370 | 1.00 | THRB (0.42) | THRBTHRAITGB3ITGA2BCNR2 |
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-5346647-A | Cyclohexane compounds used in liquid crystalline mixtures | HOFFMANN-LA ROCHE INC. (US) | 1994-09-13 | — | — | US | disclosed |