Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 19/20 | 1.00 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.86 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.86 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.83 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.83 |
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 | |
|---|---|---|---|---|
| SCHEMBL10322316 | 1.00 | ADORA3 (1.00) | ADORA3ADORA1ADORA2AABCG2KCNH2 | |
| SCHEMBL24615110 | 1.00 | ADORA3 (1.00) | ADORA3ADORA1ADORA2AABCG2KCNH2 | |
| SCHEMBL29527265 | 1.00 | ADORA3 (1.00) | ADORA3ADORA1ADORA2AABCG2KCNH2 | |
| SCHEMBL11346561 | 1.00 | ADORA3 (1.00) | ADORA3ADORA1ADORA2AABCG2KCNH2 | |
| SCHEMBL10322107 | 0.96 | ADORA3 (1.00) | ADORA3ADORA1ADORA2AABCG2KCNH2 | |
| SCHEMBL16361557 | 0.96 | ADORA3 (1.00) | ADORA3ADORA1ADORA2AABCG2KCNH2 | |
| SCHEMBL11299472 | 0.93 | ADORA3 (0.88) | ADORA3ADORA1ADORA2AABCG2KCNH2 | |
| SCHEMBL10322290 | 0.93 | ADORA3 (1.00) | ADORA3ADORA1ADORA2AABCG2KCNH2 | |
| SCHEMBL16361556 | 0.93 | ADORA3 (1.00) | ADORA3ADORA1ADORA2AABCG2KCNH2 | |
| SCHEMBL16361901 | 0.93 | ADORA3 (1.00) | ADORA3ADORA1ADORA2AABCG2KCNH2 |
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-8916570-B2 | A3 adenosine receptor agonists and antagonists | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2014-12-23 | — | — | US | disclosed |