Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 3/20 | 0.56 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.56 |
| ▸ | S1PR5 | Q9H228 | 3/20 | 0.56 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.45 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.45 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | SPHK2 | Q9NRA0 | 2/20 | 0.41 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | LSS | P48449 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22363324 | 1.00 | S1PR1 (0.56) | S1PR1S1PR3S1PR5S1PR4CYP1A2 | |
| SCHEMBL22363289 | 1.00 | S1PR1 (0.56) | S1PR1S1PR3S1PR5S1PR4CYP1A2 | |
| SCHEMBL294038 | 1.00 | S1PR1 (0.56) | S1PR1S1PR3S1PR5S1PR4CYP1A2 | |
| SCHEMBL14539275 | 1.00 | S1PR1 (0.56) | S1PR1S1PR3S1PR5S1PR4CYP1A2 | |
| Fluoride SCHEMBL29251661 | 0.98 | S1PR1 (0.55) | S1PR1S1PR3S1PR5S1PR4CYP1A2 | |
| SCHEMBL292866 | 0.98 | S1PR1 (0.54) | S1PR1S1PR3S1PR5S1PR4CYP1A2 | |
| SCHEMBL27551089 | 0.94 | S1PR1 (0.57) | S1PR1S1PR3S1PR5S1PR4CYP1A2 | |
| SCHEMBL27287754 | 0.94 | S1PR1 (0.57) | S1PR1S1PR3S1PR5S1PR4CYP1A2 | |
| SCHEMBL28111758 | 0.94 | S1PR1 (0.57) | S1PR1S1PR3S1PR5S1PR4CYP1A2 | |
| SCHEMBL4419378 | 0.94 | S1PR1 (0.57) | S1PR1S1PR3S1PR5S1PR4CYP1A2 |
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-106265697-A | Salicylic acid mixture and preparation method thereof, salicylic acid ionic liquid solution and the purposes of ionic liquid | 武汉软件工程职业学院 | 2017-01-04 | — | — | CN | claimed |