Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 9/20 | 0.41 |
| ▸ | CNR1 | P21554 | 4/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.33 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11840638 | 0.99 | KDR (0.46) | KDRCNR2CNR1OPRM1ACE2 | |
| SCHEMBL11826974 | 0.90 | CNR2 (0.40) | KDRCNR2CNR1OPRM1ACE2 | |
| SCHEMBL11829169 | 0.89 | CNR2 (0.39) | KDRCNR2CNR1OPRM1ACE2 | |
| SCHEMBL11833016 | 0.89 | CNR2 (0.39) | KDRCNR2CNR1OPRM1ACE2 | |
| SCHEMBL11834421 | 0.89 | CNR2 (0.39) | KDRCNR2CNR1OPRM1ACE2 | |
| SCHEMBL11826906 | 0.88 | CNR2 (0.39) | KDRCNR2CNR1OPRM1ACE2 | |
| SCHEMBL11831061 | 0.86 | CNR2 (0.39) | KDRCNR2CNR1 | |
| SCHEMBL11828235 | 0.84 | CNR2 (0.46) | CNR2CNR1OPRM1ACE2 | |
| SCHEMBL11837577 | 0.82 | CNR2 (0.39) | CNR2CNR1 | |
| SCHEMBL11827132 | 0.81 | KDR (0.35) | KDRCNR2CNR1OPRM1ACE2 |
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-3931232-A | 3-Alkyl xanthene compounds | SMITHKLINE CORPORATION (US) | 1976-01-06 | — | — | US | disclosed |