Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 13/20 | 0.47 |
| ▸ | SPHK2 | Q9NRA0 | 7/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.34 |
| ▸ | RARB | P10826 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9758163 | 0.96 | SPHK1 (0.49) | SPHK1SPHK2ESR2RARBHRH3 | |
| SCHEMBL9758237 | 0.96 | SPHK1 (0.50) | SPHK1SPHK2ESR2 | |
| SCHEMBL9758241 | 0.96 | SPHK1 (0.50) | SPHK1SPHK2ESR2 | |
| SCHEMBL9759580 | 0.95 | SPHK1 (0.51) | SPHK1SPHK2RARB | |
| SCHEMBL9758498 | 0.94 | SPHK1 (0.50) | SPHK1SPHK2RARBHRH3 | |
| SCHEMBL9758896 | 0.93 | SPHK1 (0.56) | SPHK1SPHK2RARBHRH3 | |
| SCHEMBL9759747 | 0.92 | SPHK1 (0.58) | SPHK1SPHK2RARB | |
| SCHEMBL9759147 | 0.92 | SPHK1 (0.52) | SPHK1SPHK2ESR2 | |
| SCHEMBL9759141 | 0.92 | SPHK1 (0.52) | SPHK1SPHK2ESR2 | |
| SCHEMBL9759358 | 0.92 | SPHK1 (0.43) | SPHK1SPHK2ESR2P2RY14 |
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 |
|---|---|---|---|---|---|---|---|
| US-4985583-A | Liquid Crystals | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-01-15 | — | — | US | disclosed |
| EP-0154849-A2 | Cyclohexane derivatives | MERCK PATENT GmbH (DE) | 1985-09-18 | — | — | EP | disclosed |