Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5872189 | 0.87 | MEN1 (0.39) | — | |
| SCHEMBL5871994 | 0.86 | MME (0.37) | — | |
| SCHEMBL9185293 | 0.82 | TRPA1 (0.40) | TRPA1 | |
| SCHEMBL5871216 | 0.80 | PPARA (0.40) | TRPA1ALDH1A1TSHR | |
| SCHEMBL9602863 | 0.79 | CYP3A4 (0.40) | ALDH1A1 | |
| SCHEMBL8545986 | 0.79 | CYP2A6 (0.42) | ALDH1A1TSHR | |
| SCHEMBL8807198 | 0.79 | ALDH1A1 (0.36) | ALDH1A1TSHR | |
| SCHEMBL9602332 | 0.77 | PDE4A (0.35) | — | |
| SCHEMBL5973112 | 0.76 | TRPA1 (0.30) | TRPA1ALDH1A1TSHR | |
| SCHEMBL6160186 | 0.74 | TAAR1 (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0496548-A1 | Carbacyclin analogs | PURDUE RESEARCH FOUNDATION (US) | 1992-07-29 | — | — | EP | disclosed |