Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 19/20 | 0.72 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.55 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL2020759 | 0.89 | S1PR1 (0.90) | S1PR1S1PR5S1PR4 | |
| SCHEMBL2022295 | 0.89 | S1PR1 (0.90) | S1PR1S1PR5S1PR4 | |
| SCHEMBL2015932 | 0.89 | S1PR1 (0.90) | S1PR1S1PR5S1PR4 | |
| SCHEMBL28538175 | 0.86 | S1PR1 (0.81) | S1PR1S1PR5S1PR4 | |
| SCHEMBL14321367 | 0.86 | S1PR1 (0.57) | S1PR1S1PR5S1PR4 | |
| SCHEMBL2019616 | 0.86 | S1PR1 (0.57) | S1PR1S1PR5S1PR4 | |
| SCHEMBL2021315 | 0.85 | S1PR1 (0.84) | S1PR1S1PR5S1PR4 | |
| SCHEMBL28519461 | 0.84 | S1PR1 (0.53) | S1PR1S1PR5S1PR4 | |
| SCHEMBL2019406 | 0.83 | S1PR1 (1.00) | S1PR1S1PR5S1PR4 | |
| SCHEMBL2017941 | 0.83 | S1PR1 (1.00) | S1PR1S1PR5S1PR4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105816453-B | Substituted tricyclic acid derivatives as S1P1 receptor agonists for the treatment of autoimmune and inflammatory disorders | 艾尼纳制药公司 | 2021-03-05 | — | — | CN | disclosed |