Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.36 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9707769 | 0.95 | ADORA3 (0.39) | ADORA3ADORA1PPARGAGTR1AGTR2 | |
| SCHEMBL9707740 | 0.94 | PPARG (0.35) | PPARGAGTR1AGTR2 | |
| SCHEMBL9707739 | 0.92 | ADORA3 (0.47) | ADORA3ADORA1 | |
| SCHEMBL9708282 | 0.91 | ADORA3 (0.38) | ADORA3ADORA1 | |
| SCHEMBL9708044 | 0.91 | ALDH1A1 (0.38) | — | |
| SCHEMBL9707862 | 0.91 | PPARG (0.37) | PPARG | |
| SCHEMBL9707995 | 0.91 | ADORA3 (0.40) | ADORA3ADORA1 | |
| SCHEMBL9708454 | 0.91 | AGTR1 (0.41) | ADORA3ADORA1AGTR1AGTR2 | |
| SCHEMBL9708648 | 0.90 | ADORA1 (0.42) | ADORA3ADORA1 | |
| SCHEMBL9707508 | 0.90 | ADORA3 (0.42) | ADORA3ADORA1 |
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-1992007852-A1 | BIPHENYLALKYL XANTHINE COMPOUNDS FOR TREATMENT OF CARDIOVASCULAR DISORDERS | G.D. SEARLE & CO. (US) | 1992-05-14 | — | — | WO | disclosed |