Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 17/20 | 0.45 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9521541 | 0.82 | AOC3 (0.43) | S1PR1NR1I2CYP3A4CYP2D6 | |
| SCHEMBL9520640 | 0.81 | MAPT (0.40) | S1PR1CYP3A4CYP2D6 | |
| SCHEMBL9521081 | 0.81 | MAPT (0.41) | S1PR1 | |
| SCHEMBL8137702 | 0.79 | NR1I2 (0.68) | S1PR1NR1I2CYP3A4CYP2D6 | |
| SCHEMBL9521718 | 0.78 | CYP3A4 (0.55) | S1PR1NR1I2CYP3A4CYP2D6 | |
| SCHEMBL9521646 | 0.77 | S1PR1 (0.50) | S1PR1 | |
| SCHEMBL9520566 | 0.76 | NR1I2 (0.44) | NR1I2CYP3A4CYP2D6SPHK2 | |
| SCHEMBL9522218 | 0.76 | MAPT (0.39) | — | |
| SCHEMBL9521817 | 0.74 | CYP3A4 (0.51) | S1PR1NR1I2CYP3A4CYP2D6 | |
| SCHEMBL9520549 | 0.74 | CYP3A4 (0.51) | S1PR1NR1I2CYP3A4CYP2D6 |
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-0523803-A1 | 1,2,4-Oxadiazolyl-phenoxy-alkylisoxazoles and their use as antiviral agents | STERLING WINTHROP INC. (US) | 1993-01-20 | — | — | EP | disclosed |