Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 20/20 | 0.76 |
| ▸ | S1PR3 | Q99500 | 10/20 | 0.76 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.62 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL2994838 | 0.91 | S1PR1 (0.91) | S1PR1S1PR3KCNH2S1PR5 | |
| SCHEMBL2989348 | 0.91 | S1PR1 (0.75) | S1PR1S1PR3KCNH2S1PR5CYP3A4 | |
| Hydrochloric Acid SCHEMBL2994159 | 0.91 | S1PR1 (0.90) | S1PR1S1PR3KCNH2S1PR5 | |
| SCHEMBL2989736 | 0.90 | S1PR1 (0.72) | S1PR1S1PR3KCNH2S1PR5CYP3A4 | |
| SCHEMBL2987514 | 0.88 | S1PR1 (0.83) | S1PR1S1PR3KCNH2S1PR5 | |
| SCHEMBL2995426 | 0.87 | S1PR1 (0.72) | S1PR1S1PR3KCNH2S1PR5 | |
| Acetic Acid SCHEMBL2995423 | 0.87 | S1PR1 (0.81) | S1PR1S1PR3KCNH2S1PR5 | |
| SCHEMBL3068572 | 0.87 | S1PR1 (0.82) | S1PR1S1PR3KCNH2S1PR5 | |
| SCHEMBL10455335 | 0.85 | S1PR1 (0.68) | S1PR1S1PR3KCNH2S1PR5CYP3A4 | |
| SCHEMBL2992437 | 0.82 | S1PR1 (0.73) | S1PR1S1PR3KCNH2S1PR5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2222669-A1 | OXADIAZOLE DERIVATIVES ACTIVE ON SPHINGOSINE-1-PHOSPHATE (SIP) | Glaxo Group Limited (GB) | 2010-09-01 | — | — | EP | disclosed |
| WO-2009080725-A1 | OXADIAZOLE DERIVATIVES ACTIVE ON SPHINGOSINE-1-PHOSPHATE (SIP) | GLAXO GROUP LIMITED (GB) | 2009-07-02 | — | — | WO | disclosed |