Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 18/20 | 0.45 |
| ▸ | PLK1 | P53350 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | TDO2 | P48775 | 1/20 | 0.37 |
| ▸ | IDO2 | Q6ZQW0 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL20154952 | 0.98 | BRD4 (0.43) | BRD4PLK1IDO1TDO2IDO2 | |
| SCHEMBL20155286 | 0.90 | BRD4 (0.46) | BRD4 | |
| SCHEMBL20155074 | 0.89 | BRD4 (0.51) | BRD4 | |
| SCHEMBL20155018 | 0.88 | BRD4 (0.45) | BRD4 | |
| SCHEMBL20155336 | 0.88 | BRD4 (0.48) | BRD4 | |
| SCHEMBL20154956 | 0.87 | BRD4 (0.49) | BRD4 | |
| SCHEMBL20155086 | 0.80 | BRD4 (0.44) | BRD4 | |
| SCHEMBL20154976 | 0.80 | BRD4 (0.39) | BRD4 | |
| SCHEMBL20155071 | 0.78 | ACKR3 (0.37) | PLK1IDO1TDO2IDO2 | |
| SCHEMBL20155287 | 0.78 | BRD4 (0.62) | 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 |