Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5266054 | 1.00 | HTT (0.30) | HTTMAOAMAOB | |
| SCHEMBL27606471 | 1.00 | HTT (0.30) | HTTMAOAMAOB | |
| SCHEMBL5262406 | 0.83 | HTT (0.36) | HTTMAOAMAOB | |
| SCHEMBL5261316 | 0.83 | HTT (0.36) | HTTMAOAMAOB | |
| SCHEMBL3579608 | 0.77 | KCNH2 (0.38) | — | |
| SCHEMBL5264047 | 0.77 | KCNH2 (0.38) | — | |
| SCHEMBL3573905 | 0.77 | KCNH2 (0.38) | — | |
| SCHEMBL3581981 | 0.77 | KCNH2 (0.38) | — | |
| SCHEMBL14498878 | 0.76 | KCNH2 (0.48) | — | |
| SCHEMBL14498881 | 0.76 | KCNH2 (0.48) | — |
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-1399443-B1 | NITROGEN-CONTAINING BICYCLIC HETEROCYCLES FOR USE AS ANTIBACTERIALS | SMITHKLINE BEECHAM PLC (GB) | 2007-12-12 | — | — | EP | claimed |
| EP-1399443-B1 | NITROGEN-CONTAINING BICYCLIC HETEROCYCLES FOR USE AS ANTIBACTERIALS | SMITHKLINE BEECHAM PLC (GB) | 2007-12-12 | — | — | EP | disclosed |