Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 5/20 | 0.49 |
| ▸ | PDE4A | P27815 | 5/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 5/20 | 0.49 |
| ▸ | PDE4C | Q08493 | 5/20 | 0.49 |
| ▸ | PDE4D | Q08499 | 5/20 | 0.49 |
| ▸ | ADORA2B | P29275 | 8/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | XDH | P47989 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10506396 | 0.81 | ADORA2B (0.50) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL9432917 | 0.77 | ADORA2A (0.55) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL10535015 | 0.74 | ADORA2A (0.57) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL9432924 | 0.74 | ADORA2B (0.71) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL12413533 | 0.72 | ADORA2B (0.63) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL31081359 | 0.71 | ADORA2B (0.74) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL150602 | 0.70 | ADORA2B (0.59) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL897035 | 0.70 | ADORA2B (0.55) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5451521 | 0.68 | ADORA2B (0.68) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL27614352 | 0.68 | PDE4A (0.54) | ADORA2APDE4APDE4BPDE4CPDE4D |
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 |
|---|---|---|---|---|---|---|---|
| US-5338741-A | Cardiotonic agents | NESTEC S.A. (CH) | 1994-08-16 | — | — | US | disclosed |