Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 19/20 | 0.66 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.58 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL13913872 | 0.93 | ADORA1 (0.76) | ADORA1ADORA2B | |
| SCHEMBL13914112 | 0.91 | ADORA1 (0.64) | ADORA1ADORA2B | |
| SCHEMBL13914017 | 0.90 | ADORA1 (0.64) | ADORA1ADORA2B | |
| SCHEMBL13913930 | 0.87 | ADORA1 (0.63) | ADORA1 | |
| SCHEMBL13913915 | 0.87 | ADORA1 (0.63) | ADORA1ADORA2B | |
| SCHEMBL13913883 | 0.87 | SIRT1 (0.56) | ADORA1SIRT1ADORA2B | |
| SCHEMBL13913954 | 0.86 | KDM4E (0.63) | ADORA1 | |
| SCHEMBL13913983 | 0.85 | ADORA1 (0.68) | ADORA1ADORA2B | |
| SCHEMBL13914105 | 0.85 | ADORA1 (0.70) | ADORA1ADORA2B | |
| SCHEMBL13913880 | 0.84 | ADORA1 (0.59) | ADORA1SIRT1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7504421-B2 | Substituted 2-thio-3,5-dicyano-4-aryl-6-aminopyridines and their use | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-03-17 | — | — | US | disclosed |
| US-7504421-B2 | Substituted 2-thio-3,5-dicyano-4-aryl-6-aminopyridines and their use | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-03-17 | — | — | US | disclosed |