Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 17/20 | 0.55 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL948110 | 0.89 | S1PR1 (0.59) | S1PR1S1PR4ADORA3S1PR5 | |
| SCHEMBL944763 | 0.83 | TRPV1 (0.50) | TRPV1 | |
| SCHEMBL950202 | 0.82 | S1PR1 (0.60) | S1PR1S1PR4S1PR5 | |
| SCHEMBL949739 | 0.82 | S1PR1 (0.53) | S1PR1S1PR4ADORA3S1PR5 | |
| SCHEMBL945721 | 0.81 | MAPKAPK2 (0.56) | S1PR1 | |
| Hydrochloric Acid SCHEMBL949245 | 0.79 | S1PR1 (0.81) | S1PR1S1PR4S1PR5 | |
| SCHEMBL947736 | 0.78 | SLC6A4 (0.42) | TRPV1 | |
| SCHEMBL945300 | 0.77 | S1PR1 (0.75) | S1PR1S1PR4ADORA3S1PR5 | |
| SCHEMBL946705 | 0.77 | S1PR1 (0.68) | S1PR1S1PR4ADORA3S1PR5 | |
| SCHEMBL951334 | 0.77 | S1PR1 (0.60) | S1PR1 |
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-2011005295-A1 | MODULATORS OF THE SPHINGOSINE-1-PHOSPHATE (S1P) RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO | ARENA PHARMACEUTICALS, INC. (US) | 2011-01-13 | — | — | WO | disclosed |