Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 20/20 | 0.67 |
| ▸ | S1PR3 | Q99500 | 14/20 | 0.67 |
| ▸ | S1PR4 | O95977 | 3/20 | 0.53 |
| ▸ | S1PR5 | Q9H228 | 3/20 | 0.53 |
| ▸ | S1PR2 | O95136 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL13665143 | 1.00 | S1PR1 (0.67) | S1PR1S1PR3S1PR4S1PR5S1PR2 | |
| SCHEMBL13665563 | 1.00 | S1PR1 (0.67) | S1PR1S1PR3S1PR4S1PR5S1PR2 | |
| SCHEMBL13851946 | 0.91 | S1PR1 (0.78) | S1PR1S1PR3S1PR4S1PR5S1PR2 | |
| SCHEMBL29735087 | 0.91 | S1PR1 (0.78) | S1PR1S1PR3S1PR4S1PR5S1PR2 | |
| SCHEMBL13851934 | 0.91 | S1PR1 (0.78) | S1PR1S1PR3S1PR4S1PR5S1PR2 | |
| SCHEMBL13851931 | 0.91 | S1PR1 (0.78) | S1PR1S1PR3S1PR4S1PR5S1PR2 | |
| SCHEMBL13463831 | 0.91 | S1PR1 (0.78) | S1PR1S1PR3S1PR4S1PR5S1PR2 | |
| SCHEMBL13851944 | 0.91 | S1PR1 (0.78) | S1PR1S1PR3S1PR4S1PR5S1PR2 | |
| SCHEMBL13851933 | 0.91 | S1PR1 (0.78) | S1PR1S1PR3S1PR4S1PR5S1PR2 | |
| SCHEMBL86567 | 0.90 | S1PR1 (0.61) | S1PR1S1PR3S1PR4S1PR5S1PR2 |
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-2009119858-A1 | BENZENE COMPOUND, AND USE THEREOF FOR MEDICAL PURPOSES | 田辺三菱製薬株式会社 (JP) | 2009-10-01 | — | — | WO | disclosed |