Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 3/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL20155483 | 0.84 | MAPK14 (0.37) | BRD4 | |
| SCHEMBL20155590 | 0.72 | MAPK14 (0.36) | BRD4 | |
| SCHEMBL20155643 | 0.72 | BRD4 (0.35) | BRD4 | |
| SCHEMBL20155635 | 0.72 | MAPK14 (0.33) | BRD4 | |
| SCHEMBL20155637 | 0.71 | BRD4 (0.36) | BRD4 | |
| SCHEMBL20155534 | 0.70 | BRD4 (0.36) | BRD4 | |
| SCHEMBL20155748 | 0.70 | MAPK14 (0.34) | BRD4 | |
| SCHEMBL20155584 | 0.69 | BRD4 (0.43) | BRD4 | |
| SCHEMBL20155583 | 0.69 | BRD4 (0.36) | BRD4 | |
| SCHEMBL20155650 | 0.68 | AKT1 (0.31) | BRD4 |
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 |