Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 20/20 | 0.55 |
| ▸ | S1PR3 | Q99500 | 7/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2122355 | 0.90 | S1PR1 (0.55) | S1PR1S1PR3KCNH2 | |
| SCHEMBL3428119 | 0.89 | S1PR1 (0.51) | S1PR1S1PR3KCNH2 | |
| SCHEMBL3431138 | 0.87 | S1PR1 (0.74) | S1PR1S1PR3KCNH2 | |
| SCHEMBL2131002 | 0.86 | S1PR1 (0.52) | S1PR1S1PR3KCNH2 | |
| SCHEMBL2123703 | 0.85 | S1PR1 (0.52) | S1PR1S1PR3KCNH2 | |
| SCHEMBL2128462 | 0.83 | S1PR1 (0.54) | S1PR1S1PR3KCNH2 | |
| SCHEMBL3430901 | 0.82 | S1PR1 (0.61) | S1PR1S1PR3KCNH2 | |
| SCHEMBL3430660 | 0.81 | S1PR1 (0.55) | S1PR1S1PR3KCNH2 | |
| SCHEMBL2122460 | 0.80 | S1PR1 (0.57) | S1PR1S1PR3KCNH2 | |
| SCHEMBL2602093 | 0.79 | S1PR1 (0.48) | S1PR1S1PR3KCNH2 |
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-2010146105-A1 | S1P1 AGONISTS COMPRISING A BICYCLIC N-CONTAINING RING | GLAXO GROUP LIMITED (GB) | 2010-12-23 | — | — | WO | disclosed |