Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 19/20 | 0.61 |
| ▸ | REN | P00797 | 18/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 8/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL3129633 | 0.95 | KCNH2 (0.68) | KCNH2RENCYP3A4 | |
| SCHEMBL3132499 | 0.91 | KCNH2 (0.74) | KCNH2RENCYP3A4 | |
| SCHEMBL3051640 | 0.89 | KCNH2 (0.66) | KCNH2RENCYP3A4 | |
| SCHEMBL3129881 | 0.88 | KCNH2 (0.77) | KCNH2RENCYP3A4 | |
| SCHEMBL3046487 | 0.88 | REN (0.67) | KCNH2RENCYP3A4 | |
| SCHEMBL3127030 | 0.87 | KCNH2 (0.66) | KCNH2RENCYP3A4 | |
| SCHEMBL3129750 | 0.87 | KCNH2 (0.76) | KCNH2RENCYP3A4 | |
| SCHEMBL3043297 | 0.87 | KCNH2 (0.66) | KCNH2RENCYP3A4 | |
| SCHEMBL3134864 | 0.86 | REN (0.66) | KCNH2RENCYP3A4 | |
| SCHEMBL3049048 | 0.86 | KCNH2 (0.78) | 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 |
|---|---|---|---|---|---|---|---|
| EP-2097377-B1 | RENIN INHIBITORS | MERCK FROSST CANADA LTD (CA) | 2010-07-07 | — | — | EP | disclosed |