Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 4/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.33 |
| ▸ | RORC | P51449 | 9/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | DUT | P33316 | 1/20 | 0.32 |
| ▸ | IL17A | Q16552 | 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 | |
|---|---|---|---|---|
| SCHEMBL21190849 | 0.90 | BRD4 (0.44) | BRD4PDE4BRORCPDE4APDE4C | |
| SCHEMBL16658431 | 0.86 | LPL (0.35) | BRD4 | |
| SCHEMBL1438795 | 0.86 | LPL (0.35) | PDE4BRORCPDE4APDE4CPDE4D | |
| SCHEMBL15069539 | 0.82 | BRD4 (0.46) | BRD4RORCPTGS1PTGS2 | |
| SCHEMBL16650807 | 0.81 | BRD4 (0.44) | BRD4 | |
| SCHEMBL984993 | 0.81 | CNR2 (0.35) | PDE4B | |
| SCHEMBL16651855 | 0.81 | BRD4 (0.47) | BRD4PTGS1PTGS2 | |
| SCHEMBL21191141 | 0.81 | BRD4 (0.39) | BRD4PDE4BRORCPDE4APDE4C | |
| SCHEMBL16650483 | 0.79 | BRD4 (0.46) | BRD4 | |
| SCHEMBL21190751 | 0.78 | BRD4 (0.45) | BRD4PDE4BPDE4APDE4CPDE4D |
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 |