Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 13/20 | 0.45 |
| ▸ | SPHK2 | Q9NRA0 | 7/20 | 0.41 |
| ▸ | THRA | P10827 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10416782 | 1.00 | SPHK1 (0.45) | SPHK1SPHK2THRATHRBALDH1A1 | |
| SCHEMBL10418107 | 1.00 | SPHK1 (0.45) | SPHK1SPHK2THRATHRBALDH1A1 | |
| SCHEMBL10416773 | 1.00 | SPHK1 (0.45) | SPHK1SPHK2THRATHRBALDH1A1 | |
| SCHEMBL10416774 | 1.00 | SPHK1 (0.45) | SPHK1SPHK2THRATHRBALDH1A1 | |
| SCHEMBL10418110 | 1.00 | SPHK1 (0.45) | SPHK1SPHK2THRATHRBALDH1A1 | |
| SCHEMBL10418985 | 0.99 | SPHK1 (0.43) | SPHK1SPHK2THRATHRB | |
| SCHEMBL10418986 | 0.99 | SPHK1 (0.43) | SPHK1SPHK2THRATHRB | |
| SCHEMBL10418078 | 0.96 | SPHK1 (0.39) | SPHK1SPHK2 | |
| SCHEMBL10418079 | 0.96 | SPHK1 (0.39) | SPHK1SPHK2 | |
| SCHEMBL10416709 | 0.92 | AOC3 (0.36) | SPHK1 |
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-4925590-A | Derivatives of 4-cyano-2,3-difluorophenol | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1990-05-15 | — | — | US | disclosed |