Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 7/20 | 0.45 |
| ▸ | SLC40A1 | Q9NP59 | 3/20 | 0.39 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14573148 | 0.85 | KCNH2 (0.47) | KCNH2SLC40A1SLC2A1 | |
| SCHEMBL5657093 | 0.82 | CHRNA7 (0.47) | SLC40A1 | |
| SCHEMBL5765657 | 0.81 | KCNH2 (0.47) | KCNH2SLC40A1SLC2A1 | |
| SCHEMBL5774180 | 0.78 | KCNH2 (0.42) | KCNH2SLC40A1SLC2A1 | |
| SCHEMBL14573161 | 0.77 | SLC40A1 (0.40) | KCNH2SLC40A1SLC2A1 | |
| SCHEMBL6664492 | 0.77 | KCNH2 (0.41) | KCNH2 | |
| SCHEMBL3250060 | 0.76 | KCNH2 (0.62) | KCNH2SLC2A1 | |
| SCHEMBL6667458 | 0.75 | KCNH2 (0.45) | KCNH2 | |
| SCHEMBL6666169 | 0.75 | KCNH2 (0.49) | KCNH2 | |
| SCHEMBL6661599 | 0.74 | SLC2A1 (0.36) | KCNH2SLC40A1SLC2A1 |
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-1392686-A1 | BICYCLIC NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVES FOR USE AS ANTIBACTERIALS | SMITHKLINE BEECHAM PLC (GB) | 2004-03-03 | — | — | EP | claimed |
| WO-2002096907-A1 | BICYCLIC NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVES FOR USE AS ANTIBACTERIALS | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-12-05 | — | — | WO | claimed |