Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP2A | P11388 | 1/20 | 0.61 |
| ▸ | KCNH2 | Q12809 | 14/20 | 0.44 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21372284 | 0.97 | TOP2A (0.65) | TOP2AKCNH2SLC2A1 | |
| SCHEMBL3324852 | 0.91 | TOP2A (0.61) | TOP2AKCNH2SLC2A1 | |
| SCHEMBL4442980 | 0.91 | TOP2A (0.61) | TOP2AKCNH2SLC2A1 | |
| Hydrochloric Acid SCHEMBL3324554 | 0.90 | TOP2A (0.60) | TOP2AKCNH2SLC2A1 | |
| SCHEMBL21371892 | 0.89 | TOP2A (0.59) | TOP2AKCNH2SLC2A1 | |
| SCHEMBL3330008 | 0.89 | TOP2A (0.59) | TOP2AKCNH2SLC2A1 | |
| Hydrochloric Acid SCHEMBL3327699 | 0.88 | TOP2A (0.58) | TOP2AKCNH2SLC2A1 | |
| SCHEMBL21371952 | 0.88 | TOP2A (0.65) | TOP2AKCNH2SLC2A1 | |
| SCHEMBL3326783 | 0.88 | TOP2A (0.65) | TOP2AKCNH2SLC2A1 | |
| SCHEMBL21898777 | 0.88 | TOP2A (0.49) | 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-3639824-A1 | TRICYCLIC NITROGEN CONTAINING COMPOUNDS FOR TREATING NEISSERIA GONORRHOEA INFECTION | GlaxoSmithKline Intellectual Property Development Limited (GB) | 2020-04-22 | — | — | EP | disclosed |
| EP-3182973-B1 | TRICYCLIC NITROGEN CONTAINING COMPOUNDS FOR TREATING NEISSERIA GONORRHOEA INFECTION | GLAXOSMITHKLINE IP DEV LTD (GB) | 2019-09-18 | — | — | EP | disclosed |