Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 13/20 | 0.47 |
| ▸ | SPHK2 | Q9NRA0 | 7/20 | 0.42 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL9841514 | 0.99 | SPHK1 (0.49) | SPHK1SPHK2S1PR3 | |
| Fluoride SCHEMBL9841694 | 0.99 | SPHK1 (0.49) | SPHK1SPHK2S1PR3 | |
| Fluoride SCHEMBL9841819 | 0.99 | SPHK1 (0.49) | SPHK1SPHK2S1PR3 | |
| Fluoride SCHEMBL9841688 | 0.96 | SPHK1 (0.42) | SPHK1SPHK2GPR84 | |
| Fluoride SCHEMBL9841638 | 0.91 | SPHK1 (0.35) | SPHK1SPHK2 | |
| Fluoride SCHEMBL9841733 | 0.86 | ESR2 (0.33) | — | |
| SCHEMBL11162842 | 0.85 | SPHK1 (0.50) | SPHK1SPHK2S1PR3 | |
| SCHEMBL9841600 | 0.83 | SPHK1 (0.45) | SPHK1SPHK2S1PR3HRH3 | |
| SCHEMBL11152533 | 0.82 | SPHK1 (0.43) | SPHK1SPHK2 | |
| SCHEMBL9841517 | 0.82 | SPHK1 (0.47) | SPHK1SPHK2S1PR3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5055223-A | For use in liquid crystal display elements | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-10-08 | — | — | US | disclosed |