Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 18/20 | 0.46 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12176514 | 0.92 | S1PR1 (0.43) | S1PR1S1PR3CYP2C9NOTUM | |
| SCHEMBL12102825 | 0.85 | S1PR1 (0.58) | S1PR1S1PR3CYP2C9 | |
| SCHEMBL12176280 | 0.83 | S1PR1 (0.58) | S1PR1S1PR3CYP2C9 | |
| SCHEMBL12102741 | 0.77 | S1PR1 (0.56) | S1PR1S1PR3CYP2C9 | |
| SCHEMBL12102768 | 0.77 | S1PR1 (0.59) | S1PR1S1PR3CYP2C9 | |
| SCHEMBL13974005 | 0.76 | S1PR1 (0.59) | S1PR1S1PR3CYP2C9 | |
| SCHEMBL12175443 | 0.75 | S1PR1 (0.54) | S1PR1S1PR3 | |
| SCHEMBL12102428 | 0.71 | S1PR1 (0.42) | S1PR1S1PR3CYP2C9 | |
| SCHEMBL1293239 | 0.71 | S1PR1 (0.55) | S1PR1S1PR3CYP2C9 | |
| SCHEMBL12176644 | 0.71 | S1PR1 (0.58) | S1PR1S1PR3CYP2C9 |
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-2011134280-A1 | COMPOUNDS AS AGONISTS OF S1P1 RECEPTORS | GLAXO GROUP LIMITED (GB) | 2011-11-03 | — | — | WO | disclosed |