Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL9914 | 1.00 | TRPA1 (0.33) | TRPA1KCNH3 | |
| SCHEMBL11895749 | 1.00 | TRPA1 (0.33) | TRPA1KCNH3 | |
| SCHEMBL11954696 | 1.00 | TRPA1 (0.33) | TRPA1KCNH3 | |
| SCHEMBL11895780 | 0.89 | TRPA1 (0.36) | TRPA1KCNH3 | |
| SCHEMBL11966335 | 0.89 | TRPA1 (0.36) | TRPA1KCNH3 | |
| SCHEMBL11954685 | 0.89 | TRPA1 (0.36) | TRPA1KCNH3 | |
| SCHEMBL11954741 | 0.89 | TRPA1 (0.36) | TRPA1KCNH3 | |
| SCHEMBL14682 | 0.85 | TRPA1 (0.37) | TRPA1KCNH3 | |
| SCHEMBL2905 | 0.85 | TRPA1 (0.37) | TRPA1KCNH3 | |
| SCHEMBL11954736 | 0.85 | TRPA1 (0.37) | TRPA1KCNH3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2485737-A1 | NOVEL TRPA1 ANTAGONISTS | Merck Sharp & Dohme Corp. (US) | 2012-08-15 | — | — | EP | claimed |
| WO-2011043954-A1 | NOVEL TRPA1 ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2011-04-14 | — | — | WO | claimed |