Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNNC1 | P63316 | 5/20 | 0.51 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.51 |
| ▸ | LPL | P06858 | 2/20 | 0.51 |
| ▸ | LIPG | Q9Y5X9 | 2/20 | 0.51 |
| ▸ | SGPL1 | O95470 | 1/20 | 0.51 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.51 |
| ▸ | GPR183 | P32249 | 1/20 | 0.51 |
| ▸ | CERS2 | Q96G23 | 1/20 | 0.51 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.51 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.51 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 2/20 | 0.46 |
| ▸ | PPARA | Q07869 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL25371922 | 0.98 | S1PR1 (0.52) | TNNC1S1PR1LPLLIPGSGPL1 | |
| SCHEMBL27855495 | 0.83 | LPL (0.51) | TNNC1S1PR1LPLLIPGSGPL1 | |
| SCHEMBL13165347 | 0.82 | S1PR1 (0.54) | TNNC1S1PR1SGPL1S1PR4GPR183 | |
| SCHEMBL8498597 | 0.81 | S1PR1 (0.66) | TNNC1S1PR1LPLLIPGSGPL1 | |
| SCHEMBL26881637 | 0.81 | S1PR1 (0.66) | TNNC1S1PR1LPLLIPGSGPL1 | |
| SCHEMBL8495721 | 0.81 | S1PR1 (0.66) | TNNC1S1PR1LPLLIPGSGPL1 | |
| SCHEMBL8498533 | 0.81 | S1PR1 (0.66) | TNNC1S1PR1LPLLIPGSGPL1 | |
| SCHEMBL8500217 | 0.81 | S1PR1 (0.66) | TNNC1S1PR1LPLLIPGSGPL1 | |
| Hydrochloric Acid SCHEMBL25371925 | 0.80 | S1PR1 (0.67) | TNNC1S1PR1SGPL1S1PR4GPR183 | |
| SCHEMBL6280362 | 0.79 | LPL (0.54) | LPLLIPGPPARGPPARA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1635803-B1 | USE OF 2-AMINO-1-3-PROPANEDIOL DERIVATIVES FOR THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF VARIOUS TYPES OF PAIN | SANOFI AVENTIS DEUTSCHLAND (DE) | 2009-03-04 | — | — | EP | disclosed |