Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 20/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL21939669 | 0.89 | ADORA3 (0.71) | ADORA3 | |
| SCHEMBL21779308 | 0.86 | ADORA3 (0.79) | ADORA3KCNH2 | |
| SCHEMBL16774405 | 0.86 | ADORA3 (0.79) | ADORA3KCNH2 | |
| SCHEMBL23097508 | 0.86 | ADORA3 (0.56) | ADORA3 | |
| SCHEMBL30255500 | 0.86 | ADORA3 (0.79) | ADORA3KCNH2 | |
| SCHEMBL21939668 | 0.85 | ADORA3 (0.75) | ADORA3KCNH2 | |
| SCHEMBL23097630 | 0.85 | ADORA3 (0.75) | ADORA3 | |
| SCHEMBL22359723 | 0.85 | ADORA3 (0.75) | ADORA3 | |
| SCHEMBL23097520 | 0.84 | ADORA3 (0.75) | ADORA3 | |
| SCHEMBL23097648 | 0.83 | ADORA3 (0.59) | ADORA3KCNH2 |
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-2020168274-A1 | TREATMENT OF CHRONIC HEADACHES | SAINT LOUIS UNIVERSITY (US) | 2020-08-20 | — | — | WO | disclosed |