Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 1/20 | 0.61 |
| ▸ | TRPV1 | Q8NER1 | 19/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL23363361 | 0.85 | TRPV1 (0.56) | CFTRTRPV1CYP2D6CYP3A4 | |
| SCHEMBL23363272 | 0.85 | TRPV1 (0.50) | CFTRTRPV1CYP2D6CYP3A4 | |
| SCHEMBL2319758 | 0.83 | CFTR (0.55) | CFTRTRPV1CYP2D6CYP3A4 | |
| SCHEMBL2319764 | 0.83 | CFTR (0.55) | CFTRTRPV1CYP2D6CYP3A4 | |
| SCHEMBL23423231 | 0.80 | CFTR (0.51) | CFTRTRPV1CYP2D6CYP3A4 | |
| SCHEMBL1569902 | 0.80 | CFTR (0.47) | CFTRTRPV1CYP2D6CYP3A4 | |
| SCHEMBL23363355 | 0.79 | TRPV1 (0.52) | CFTRTRPV1CYP2D6CYP3A4 | |
| SCHEMBL15259717 | 0.78 | TRPV1 (0.47) | CFTRTRPV1CYP2D6CYP3A4 | |
| SCHEMBL15259716 | 0.78 | TRPV1 (0.47) | CFTRTRPV1CYP2D6CYP3A4 | |
| SCHEMBL29920650 | 0.78 | TRPV1 (0.50) | CFTRTRPV1CYP2D6CYP3A4 |
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-2352726-A1 | TRPV1 ANTAGONISTS | Abbott Laboratories (US) | 2011-08-10 | — | — | EP | disclosed |
| WO-2010045401-A1 | TRPV1 ANTAGONISTS | ABBOTT LABORATORIES (US) | 2010-04-22 | — | — | WO | disclosed |