Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 8/20 | 0.42 |
| ▸ | CA1 | P00915 | 8/20 | 0.42 |
| ▸ | CA2 | P00918 | 8/20 | 0.42 |
| ▸ | CA4 | P22748 | 8/20 | 0.42 |
| ▸ | CA7 | P43166 | 8/20 | 0.42 |
| ▸ | CA9 | Q16790 | 8/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 12/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11968333 | 1.00 | CA12 (0.42) | CA12CA1CA2CA4CA7 | |
| SCHEMBL2806943 | 1.00 | CA12 (0.42) | CA12CA1CA2CA4CA7 | |
| SCHEMBL2806956 | 1.00 | CA12 (0.42) | CA12CA1CA2CA4CA7 | |
| SCHEMBL2809560 | 0.96 | CA12 (0.39) | CA12CA1CA2CA4CA7 | |
| SCHEMBL2809522 | 0.96 | CA12 (0.39) | CA12CA1CA2CA4CA7 | |
| SCHEMBL4643008 | 0.94 | CA12 (0.44) | CA12CA1CA2CA4CA7 | |
| SCHEMBL2807999 | 0.94 | CA12 (0.44) | CA12CA1CA2CA4CA7 | |
| SCHEMBL2808012 | 0.94 | CA12 (0.44) | CA12CA1CA2CA4CA7 | |
| SCHEMBL2807817 | 0.93 | ADORA2A (0.43) | CA12CA1CA2CA4CA7 | |
| SCHEMBL2807801 | 0.93 | ADORA2A (0.43) | CA12CA1CA2CA4CA7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2044070-B1 | PURINE DERIVATIVES AS A2A AGONISTS | NOVARTIS AG (CH) | 2012-08-22 | — | — | EP | claimed |