Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 19/20 | 0.83 |
| ▸ | ADORA1 | P30542 | 11/20 | 0.83 |
| ▸ | ADORA2A | P29274 | 9/20 | 0.83 |
| ▸ | PPARD | Q03181 | 6/20 | 0.83 |
| ▸ | PPARG | P37231 | 3/20 | 0.65 |
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 | |
|---|---|---|---|---|
| SCHEMBL18675571 | 0.91 | ADORA3 (1.00) | ADORA3ADORA1ADORA2APPARDPPARG | |
| SCHEMBL18675339 | 0.91 | ADORA3 (0.82) | ADORA3ADORA1ADORA2APPARDPPARG | |
| SCHEMBL18675606 | 0.91 | ADORA3 (1.00) | ADORA3ADORA1ADORA2APPARDPPARG | |
| SCHEMBL18675653 | 0.91 | ADORA3 (0.82) | ADORA3ADORA1ADORA2APPARDPPARG | |
| SCHEMBL18675579 | 0.88 | ADORA3 (0.84) | ADORA3ADORA1ADORA2APPARDPPARG | |
| SCHEMBL18675572 | 0.82 | ADORA3 (0.72) | ADORA3ADORA1ADORA2APPARDPPARG | |
| SCHEMBL18675655 | 0.82 | ADORA3 (0.69) | ADORA3ADORA1ADORA2APPARDPPARG | |
| SCHEMBL18675358 | 0.81 | ADORA3 (0.72) | ADORA3ADORA1ADORA2APPARD | |
| SCHEMBL18675356 | 0.81 | ADORA3 (1.00) | ADORA3ADORA1ADORA2APPARD | |
| SCHEMBL18675350 | 0.80 | ADORA3 (0.85) | ADORA3ADORA1ADORA2APPARDPPARG |
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-2017052322-A1 | ADENOSINE DERIVATIVE, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER, CONTAINING SAME AS ACTIVE INGREDIENT | 퓨쳐메디신 주식회사 | 2017-03-30 | — | — | WO | disclosed |