Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL3263201 | 1.00 | PTGS1 (0.38) | PTGS1TSHRALDH1A1 | |
| SCHEMBL9121011 | 0.88 | — | — | |
| SCHEMBL9791540 | 0.88 | — | — | |
| SCHEMBL13660315 | 0.88 | — | — | |
| SCHEMBL12134009 | 0.86 | PTGS1 (0.34) | PTGS1 | |
| SCHEMBL27586876 | 0.85 | FAAH (0.52) | PTGS1 | |
| SCHEMBL232339 | 0.84 | — | — | |
| SCHEMBL299735 | 0.84 | — | — | |
| SCHEMBL5599745 | 0.82 | FAAH (0.42) | TSHRALDH1A1 | |
| SCHEMBL5520439 | 0.80 | FAAH (0.52) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991003449-A1 | ISOMERIZATION OF ALK-2-ENYL ETHERS | GAF CHEMICALS CORPORATION (US) | 1991-03-21 | — | — | WO | disclosed |