Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 6/20 | 0.45 |
| ▸ | AGTR1 | P30556 | 4/20 | 0.44 |
| ▸ | AGTR2 | P50052 | 4/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9707592 | 0.98 | AGTR1 (0.47) | PPARGAGTR1AGTR2 | |
| SCHEMBL9707565 | 0.95 | AGTR1 (0.44) | PPARGAGTR1AGTR2 | |
| SCHEMBL9707838 | 0.92 | AGTR1 (0.43) | AGTR1AGTR2 | |
| SCHEMBL9708301 | 0.90 | PPARG (0.46) | PPARGAGTR1AGTR2KCNH2 | |
| SCHEMBL9708201 | 0.90 | AGTR1 (0.44) | PPARGAGTR1AGTR2 | |
| SCHEMBL9708652 | 0.89 | AGTR1 (0.45) | PPARGAGTR1AGTR2 | |
| SCHEMBL9708393 | 0.89 | PPARG (0.47) | PPARGAGTR1AGTR2KCNH2 | |
| SCHEMBL9708362 | 0.89 | AGTR1 (0.44) | PPARGAGTR1AGTR2 | |
| SCHEMBL9708249 | 0.88 | AGTR1 (0.44) | PPARGAGTR1AGTR2 | |
| SCHEMBL9708625 | 0.88 | ALDH1A1 (0.38) | PPARGAGTR1AGTR2 |
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 |