Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 6/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.32 |
| ▸ | HTR5A | P47898 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2628006 | 0.83 | TRPA1 (0.43) | TRPA1HTR5A | |
| SCHEMBL12188780 | 0.75 | TRPA1 (0.42) | TRPA1ADRA2AADRA2BADRA2CHTR5A | |
| SCHEMBL14817734 | 0.72 | TRPA1 (0.46) | TRPA1ADRA2AADRA2BADRA2CHTR5A | |
| SCHEMBL14531930 | 0.68 | TRPA1 (0.50) | TRPA1HTR5A | |
| SCHEMBL19823619 | 0.65 | HTR5A (0.38) | ADRA2AADRA2BADRA2CHTR5A | |
| SCHEMBL242542 | 0.62 | — | — | |
| SCHEMBL29517242 | 0.62 | — | — | |
| SCHEMBL7572467 | 0.61 | TRPA1 (0.55) | TRPA1 | |
| Hydrochloric Acid SCHEMBL31416539 | 0.60 | TRPA1 (0.43) | TRPA1 | |
| SCHEMBL27462406 | 0.60 | — | — |
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-7435824-B2 | Prodrugs of potassium channel inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-10-14 | — | — | US | disclosed |