Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.34 |
| ▸ | BTK | Q06187 | 3/20 | 0.34 |
| ▸ | CDK4 | P11802 | 1/20 | 0.34 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | FABP6 | P51161 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2361983 | 0.81 | ALDH1A1 (0.37) | ALDH1A1GAAMAPTHSD17B10PIK3CD | |
| SCHEMBL12116975 | 0.79 | ALDH1A1 (0.50) | ALDH1A1GAAMAPTHSD17B10PIK3CD | |
| SCHEMBL13035938 | 0.79 | ALDH1A1 (0.35) | ALDH1A1GAAMAPTHSD17B10PIK3CD | |
| SCHEMBL29620781 | 0.79 | ALDH1A1 (0.35) | ALDH1A1GAAMAPTHSD17B10PIK3CD | |
| SCHEMBL25367179 | 0.76 | AR (0.36) | ALDH1A1GAAMAPTHSD17B10PIK3CD | |
| SCHEMBL3329757 | 0.75 | DHFR (0.34) | ALDH1A1GAAMAPTHSD17B10PIK3CD | |
| SCHEMBL13036607 | 0.75 | ALDH1A1 (0.36) | ALDH1A1GAAMAPTHSD17B10PIK3CD | |
| SCHEMBL3328643 | 0.75 | AR (0.35) | ALDH1A1GAAMAPTHSD17B10PIK3CD | |
| SCHEMBL16655910 | 0.75 | PIK3CD (0.33) | ALDH1A1GAAMAPTHSD17B10PIK3CD | |
| SCHEMBL30284433 | 0.70 | ADORA2A (0.43) | ALDH1A1GAAMAPTHSD17B10PIK3CD |
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 |