Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 8/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3250684 | 0.91 | KCNH2 (0.41) | KCNH2PIK3CAPIK3CDPIK3CBPIK3CG | |
| SCHEMBL3250680 | 0.91 | KCNH2 (0.41) | KCNH2PIK3CAPIK3CDPIK3CBPIK3CG | |
| SCHEMBL3453014 | 0.87 | KCNH2 (0.39) | KCNH2 | |
| SCHEMBL3378397 | 0.87 | KCNH2 (0.39) | KCNH2 | |
| SCHEMBL3409786 | 0.85 | KCNH2 (0.39) | KCNH2 | |
| SCHEMBL3409784 | 0.85 | KCNH2 (0.39) | KCNH2 | |
| SCHEMBL3375404 | 0.80 | KCNH2 (0.42) | KCNH2PIK3CAMTOR | |
| SCHEMBL2537288 | 0.80 | KCNH2 (0.44) | KCNH2 | |
| SCHEMBL3374498 | 0.80 | KCNH2 (0.44) | KCNH2 | |
| SCHEMBL2537286 | 0.80 | KCNH2 (0.44) | KCNH2 |
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-1987040-B1 | ETHANOL OR 1,2-ETHANEDIOL CYCLOHEXYL ANTIBIOTIC DERIVATIVES | ACTELION PHARMACEUTICALS LTD (CH) | 2010-11-10 | — | — | EP | claimed |