Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 16/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | EP300 | Q09472 | 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 | |
|---|---|---|---|---|
| SCHEMBL20155051 | 0.87 | BRD4 (0.35) | BRD4PDE4B | |
| SCHEMBL20155585 | 0.87 | BRD4 (0.34) | BRD4PDE4BHTR2AHTR7HTR6 | |
| SCHEMBL20155085 | 0.83 | BRD4 (0.34) | BRD4PDE4BHTR2AHTR7HTR6 | |
| SCHEMBL20155580 | 0.77 | BRD4 (0.42) | BRD4 | |
| SCHEMBL20155684 | 0.68 | BRD4 (0.35) | BRD4PDE4BEP300 | |
| SCHEMBL20155507 | 0.68 | BRD4 (0.39) | BRD4 | |
| SCHEMBL20155419 | 0.67 | BRD4 (0.33) | BRD4 | |
| SCHEMBL15552405 | 0.64 | BRD4 (0.51) | BRD4 | |
| SCHEMBL20155132 | 0.63 | BRD4 (0.52) | BRD4 | |
| SCHEMBL19931216 | 0.61 | HTR2A (0.33) | BRD4HTR2AHTR7HTR6EP300 |
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 |