Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSMB5 | P28074 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20154966 | 0.83 | BRD4 (0.35) | BRD4 | |
| SCHEMBL20155605 | 0.79 | — | — | |
| SCHEMBL20155332 | 0.76 | ADORA2A (0.36) | PSMB5BRD4 | |
| SCHEMBL20155003 | 0.75 | BRD4 (0.36) | BRD4L3MBTL1 | |
| SCHEMBL20155732 | 0.75 | GSK3B (0.30) | — | |
| SCHEMBL20155616 | 0.72 | ALDH1A1 (0.38) | BRD4 | |
| SCHEMBL20155118 | 0.70 | NPC1 (0.40) | BRD4 | |
| SCHEMBL20155045 | 0.69 | ALDH1A1 (0.39) | BRD4 | |
| SCHEMBL20155436 | 0.68 | TLR8 (0.41) | BRD4 | |
| SCHEMBL20155133 | 0.66 | ADORA2A (0.37) | — |
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 |