Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 4/20 | 0.34 |
| ▸ | BRD4 | O60885 | 3/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20155635 | 0.90 | MAPK14 (0.33) | MAPK14BRD4HSD17B10 | |
| SCHEMBL20155590 | 0.90 | MAPK14 (0.36) | MAPK14BRD4HSD17B10MEN1KMT2A | |
| SCHEMBL20155483 | 0.86 | MAPK14 (0.37) | MAPK14BRD4MEN1KMT2A | |
| SCHEMBL20155068 | 0.85 | BRD4 (0.41) | MAPK14BRD4 | |
| SCHEMBL20155062 | 0.84 | MAPK14 (0.39) | MAPK14BRD4HSD17B10MEN1KMT2A | |
| SCHEMBL20155138 | 0.82 | MAPK14 (0.36) | MAPK14BRD4HSD17B10MEN1KMT2A | |
| SCHEMBL20155186 | 0.81 | TDO2 (0.31) | — | |
| SCHEMBL20155650 | 0.78 | AKT1 (0.31) | MAPK14BRD4 | |
| SCHEMBL20155291 | 0.76 | BRD4 (0.42) | MAPK14BRD4 | |
| SCHEMBL20155621 | 0.76 | MAPK14 (0.34) | MAPK14 |
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 |