Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 9/20 | 0.65 |
| ▸ | REN | P00797 | 19/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 12/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL5069678 | 0.86 | REN (0.61) | CYP3A4RENKCNH2 | |
| SCHEMBL5069689 | 0.84 | REN (0.64) | CYP3A4RENKCNH2 | |
| SCHEMBL5136118 | 0.84 | CYP3A4 (0.65) | CYP3A4RENKCNH2 | |
| SCHEMBL664262 | 0.84 | CYP3A4 (0.82) | CYP3A4RENKCNH2 | |
| SCHEMBL4347867 | 0.82 | CYP3A4 (0.68) | CYP3A4RENKCNH2 | |
| SCHEMBL5067309 | 0.81 | REN (0.60) | CYP3A4RENKCNH2 | |
| SCHEMBL661812 | 0.81 | CYP3A4 (0.95) | CYP3A4RENKCNH2 | |
| SCHEMBL662604 | 0.81 | CYP3A4 (0.78) | CYP3A4RENKCNH2 | |
| SCHEMBL660700 | 0.80 | CYP3A4 (0.86) | CYP3A4RENKCNH2 | |
| SCHEMBL665178 | 0.80 | CYP3A4 (0.67) | CYP3A4RENKCNH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1910272-A1 | RENIN INHIBITORS | Merck Frosst Canada Ltd. (CA) | 2008-04-16 | — | — | EP | disclosed |
| WO-2007009250-A1 | RENIN INHIBITORS | MERCK FROSST CANADA LTD. (CA) | 2007-01-25 | — | — | WO | disclosed |