Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 16/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | GUCY1A1 | Q02108 | 2/20 | 0.45 |
| ▸ | GUCY1B1 | Q02153 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL27907473 | 0.91 | ADORA3 (0.56) | PDE5AADORA3KCNH2GUCY1A1GUCY1B1 | |
| SCHEMBL27925580 | 0.91 | PDE5A (0.51) | PDE5AGUCY1A1GUCY1B1 | |
| SCHEMBL27925569 | 0.82 | GUCY1A1 (0.52) | PDE5AADORA3KCNH2GUCY1A1GUCY1B1 | |
| SCHEMBL327099 | 0.81 | PDE5A (0.55) | PDE5AADORA3KCNH2 | |
| SCHEMBL9913951 | 0.78 | PDE5A (0.68) | PDE5AADORA3KCNH2 | |
| SCHEMBL173459 | 0.78 | ADORA3 (0.61) | PDE5AADORA3KCNH2 | |
| SCHEMBL16244499 | 0.78 | PDE5A (0.55) | PDE5AADORA3KCNH2GUCY1A1GUCY1B1 | |
| SCHEMBL16458548 | 0.75 | PDE5A (0.48) | PDE5AADORA3KCNH2GUCY1A1GUCY1B1 | |
| SCHEMBL9913958 | 0.75 | PDE5A (0.61) | PDE5AADORA3KCNH2GUCY1A1GUCY1B1 | |
| SCHEMBL15519039 | 0.74 | PDE5A (0.56) | PDE5AADORA3KCNH2GUCY1A1GUCY1B1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103097387-A | Ring-fused pyrimidines and triazines and use thereof for treating and/or preventing cardiovascular diseases | BAYER IP GMBH | 2013-05-08 | — | — | CN | disclosed |