Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 17/20 | 0.43 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | HSPB1 | P04792 | 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 | |
|---|---|---|---|---|
| SCHEMBL20159925 | 0.82 | BRD4 (0.62) | BRD4EPAS1 | |
| SCHEMBL20159849 | 0.77 | BRD4 (0.45) | BRD4 | |
| SCHEMBL20159993 | 0.69 | BRD4 (0.62) | BRD4 | |
| SCHEMBL15068022 | 0.68 | EPAS1 (0.46) | BRD4EPAS1HSPB1 | |
| SCHEMBL20154947 | 0.67 | EPAS1 (0.45) | BRD4EPAS1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL20160276 | 0.67 | EPAS1 (0.45) | BRD4EPAS1SLC6A2SLC6A4HSPB1 | |
| SCHEMBL16650857 | 0.66 | EPAS1 (0.67) | BRD4EPAS1HSPB1 | |
| SCHEMBL20384507 | 0.66 | EPAS1 (0.47) | EPAS1HTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL20384414 | 0.66 | EPAS1 (0.55) | EPAS1SLC6A2SLC6A4SLC6A3HSPB1 | |
| SCHEMBL20443103 | 0.65 | HTR1A (0.38) | BRD4EPAS1HTR1ASLC6A2SLC6A4 |
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-2018086585-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 |