Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP2A | P11388 | 1/20 | 0.61 |
| ▸ | KCNH2 | Q12809 | 10/20 | 0.37 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | CCR3 | P51677 | 1/20 | 0.31 |
| ▸ | PDE2A | O00408 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3333316 | 1.00 | TOP2A (0.61) | TOP2AKCNH2SLC2A1HTR1ASLC6A4 | |
| Hydrochloric Acid SCHEMBL3328271 | 0.99 | TOP2A (0.60) | TOP2AKCNH2SLC2A1HTR1ASLC6A4 | |
| SCHEMBL21372418 | 0.95 | TOP2A (0.54) | TOP2AKCNH2SLC2A1MAOBCCR3 | |
| SCHEMBL3329454 | 0.95 | TOP2A (0.54) | TOP2AKCNH2SLC2A1MAOBCCR3 | |
| Hydrochloric Acid SCHEMBL3329181 | 0.94 | TOP2A (0.54) | TOP2AKCNH2SLC2A1MAOBPDE2A | |
| SCHEMBL21371887 | 0.93 | TOP2A (0.63) | TOP2AKCNH2SLC2A1MAOB | |
| SCHEMBL3327617 | 0.93 | TOP2A (0.63) | TOP2AKCNH2SLC2A1MAOB | |
| Hydrochloric Acid SCHEMBL3328730 | 0.93 | TOP2A (0.62) | TOP2AKCNH2SLC2A1MAOB | |
| SCHEMBL21372282 | 0.89 | TOP2A (0.53) | TOP2AKCNH2SLC2A1 | |
| SCHEMBL3330445 | 0.89 | TOP2A (0.53) | 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 |