Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 11/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | SPHK2 | Q9NRA0 | 7/20 | 0.33 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.33 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10549596 | 1.00 | SPHK1 (0.37) | SPHK1SLC6A3HRH3NAMPTSPHK2 | |
| SCHEMBL10549591 | 1.00 | SPHK1 (0.37) | SPHK1SLC6A3HRH3NAMPTSPHK2 | |
| SCHEMBL10554251 | 0.96 | SPHK1 (0.42) | SPHK1HRH3SPHK2S1PR2S1PR4 | |
| SCHEMBL10552666 | 0.96 | SPHK1 (0.39) | SPHK1SLC6A3NAMPTSPHK2S1PR2 | |
| SCHEMBL10554239 | 0.96 | SPHK1 (0.42) | SPHK1HRH3SPHK2S1PR2S1PR4 | |
| SCHEMBL10552670 | 0.96 | SPHK1 (0.39) | SPHK1SLC6A3NAMPTSPHK2S1PR2 | |
| SCHEMBL10554243 | 0.96 | SPHK1 (0.42) | SPHK1HRH3SPHK2S1PR2S1PR4 | |
| SCHEMBL10552662 | 0.96 | SPHK1 (0.39) | SPHK1SLC6A3NAMPTSPHK2S1PR2 | |
| SCHEMBL10551313 | 0.95 | SPHK1 (0.37) | SPHK1SLC6A3HRH3NAMPTSPHK2 | |
| SCHEMBL10551324 | 0.95 | SPHK1 (0.37) | SPHK1SLC6A3HRH3NAMPTSPHK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0215120-B1 | CYCLOHEXANE DERIVATIVES | MERCK PATENT GmbH (DE) | 1989-08-23 | — | — | EP | disclosed |
| US-4846998-A | LIQUID CRYSTALS, ESTERS, NITRILES; ETHERS, HYDROCARBONS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1989-07-11 | — | — | US | disclosed |