Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 20/20 | 0.52 |
| ▸ | BRD2 | P25440 | 1/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.42 |
| ▸ | TSPO | P30536 | 1/20 | 0.42 |
| ▸ | EP300 | Q09472 | 1/20 | 0.42 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.42 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL20154961 | 0.94 | BRD4 (0.60) | BRD4BRD2ADORA2BTSPOEP300 | |
| SCHEMBL20155413 | 0.86 | BRD4 (0.45) | BRD4 | |
| SCHEMBL20155012 | 0.85 | BRD4 (0.61) | BRD4BRD2ADORA2BTSPOEP300 | |
| SCHEMBL20155421 | 0.80 | BRD4 (0.56) | BRD4BRD2ADORA2BTSPOEP300 | |
| SCHEMBL20154915 | 0.79 | BRD4 (0.44) | BRD4 | |
| SCHEMBL20155446 | 0.79 | BRD4 (0.49) | BRD4BRD2ADORA2BTSPOEP300 | |
| SCHEMBL20155423 | 0.79 | BRD4 (0.49) | BRD4 | |
| SCHEMBL20155414 | 0.76 | BRD4 (0.49) | BRD4BRD2ADORA2BTSPOEP300 | |
| SCHEMBL29848983 | 0.73 | BRD4 (0.68) | BRD4BRD2ADORA2BTSPOEP300 | |
| SCHEMBL16650670 | 0.73 | BRD4 (0.68) | BRD4BRD2ADORA2BTSPOEP300 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018086604-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATIONS THEREOF | 山东罗欣药业集团股份有限公司 | 2018-05-17 | — | — | WO | disclosed |