Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 19/20 | 0.71 |
| ▸ | S1PR3 | Q99500 | 11/20 | 0.71 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.47 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.47 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6093010 | 0.89 | S1PR1 (0.70) | S1PR1S1PR3 | |
| SCHEMBL1384889 | 0.88 | S1PR1 (0.61) | S1PR1S1PR3CACNA1GCACNA1HCACNA1I | |
| SCHEMBL1381068 | 0.88 | S1PR1 (0.61) | S1PR1S1PR3CACNA1GCACNA1HCACNA1I | |
| SCHEMBL2949720 | 0.86 | S1PR1 (0.93) | S1PR1S1PR3 | |
| SCHEMBL6111416 | 0.86 | S1PR1 (0.68) | S1PR1S1PR3 | |
| SCHEMBL2941999 | 0.85 | S1PR1 (0.75) | S1PR1S1PR3CACNA1GCACNA1HCACNA1I | |
| SCHEMBL6090755 | 0.85 | S1PR1 (0.76) | S1PR1S1PR3 | |
| SCHEMBL5226138 | 0.84 | S1PR1 (0.54) | S1PR1S1PR3CACNA1GCACNA1HCACNA1I | |
| SCHEMBL2948159 | 0.83 | S1PR1 (1.00) | S1PR1S1PR3 | |
| SCHEMBL2943034 | 0.81 | S1PR1 (0.80) | S1PR1S1PR3CACNA1GCACNA1HCACNA1I |
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-2006010379-A1 | NOVEL THIOPHENE DERIVATIVES AS IMMUNOSUPPRESSIVE AGENTS | ACTELION PHARMACEUTICALS LTD. (CH) | 2006-02-02 | — | — | WO | disclosed |