Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP2A | P11388 | 1/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 11/20 | 0.46 |
| ▸ | SLC2A1 | P11166 | 4/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL12902941 | 1.00 | TOP2A (0.57) | TOP2AKCNH2SLC2A1 | |
| Hydrochloric Acid SCHEMBL910543 | 0.99 | TOP2A (0.56) | TOP2AKCNH2SLC2A1 | |
| Hydrochloric Acid SCHEMBL910627 | 0.99 | TOP2A (0.56) | TOP2AKCNH2SLC2A1 | |
| SCHEMBL21371952 | 0.93 | TOP2A (0.65) | TOP2AKCNH2SLC2A1 | |
| SCHEMBL3326783 | 0.93 | TOP2A (0.65) | TOP2AKCNH2SLC2A1 | |
| Hydrochloric Acid SCHEMBL3330000 | 0.93 | TOP2A (0.65) | TOP2AKCNH2SLC2A1 | |
| SCHEMBL21371886 | 0.90 | TOP2A (0.70) | TOP2AKCNH2SLC2A1 | |
| SCHEMBL3324680 | 0.90 | TOP2A (0.70) | TOP2AKCNH2SLC2A1 | |
| Hydrochloric Acid SCHEMBL3331506 | 0.89 | TOP2A (0.69) | TOP2AKCNH2SLC2A1 | |
| SCHEMBL909984 | 0.88 | TOP2A (0.68) | TOP2AKCNH2SLC2A1 |
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-2238138-A1 | TRICYCLIC NITROGEN COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS | Glaxo Group Limited (GB) | 2010-10-13 | — | — | EP | claimed |
| WO-2009087153-A1 | TRICYCLIC NITROGEN COMPOUNDS AND THEIR USE AS ANTIBACTERIAL AGENTS | GLAXO GROUP LIMITED (GB) | 2009-07-16 | — | — | WO | claimed |