Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 18/20 | 0.53 |
| ▸ | REN | P00797 | 18/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 9/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL2795846 | 0.88 | KCNH2 (0.49) | KCNH2RENCYP3A4 | |
| SCHEMBL3034912 | 0.85 | KCNH2 (0.71) | KCNH2RENCYP3A4 | |
| SCHEMBL3048450 | 0.79 | KCNH2 (0.67) | KCNH2RENCYP3A4 | |
| SCHEMBL3047266 | 0.77 | KCNH2 (0.78) | KCNH2RENCYP3A4 | |
| SCHEMBL2781823 | 0.75 | KCNH2 (0.57) | KCNH2RENCYP3A4 | |
| SCHEMBL3132499 | 0.75 | KCNH2 (0.74) | KCNH2RENCYP3A4 | |
| SCHEMBL3047309 | 0.75 | KCNH2 (0.74) | KCNH2RENCYP3A4 | |
| SCHEMBL3044796 | 0.74 | KCNH2 (0.80) | KCNH2RENCYP3A4 | |
| SCHEMBL13323666 | 0.74 | KCNH2 (0.90) | KCNH2RENCYP3A4 | |
| SCHEMBL3129881 | 0.73 | KCNH2 (0.77) | KCNH2RENCYP3A4 |
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-2008141462-A9 | NOVEL CASE OF RENIN INHIBITORS | MERCK FROSST CANADA LTD (CA) | 2009-01-08 | — | — | WO | disclosed |