Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL3583162 | 0.87 | ADORA1 (0.59) | ADORA1SLC6A3 | |
| SCHEMBL3583157 | 0.87 | ADORA1 (0.59) | ADORA1SLC6A3 | |
| SCHEMBL3585509 | 0.87 | ADORA1 (0.59) | ADORA1SLC6A3 | |
| SCHEMBL3579432 | 0.87 | ADORA1 (0.67) | ADORA1SLC6A3 | |
| SCHEMBL13550234 | 0.87 | ADORA1 (0.67) | ADORA1SLC6A3 | |
| SCHEMBL3579435 | 0.87 | ADORA1 (0.67) | ADORA1SLC6A3 | |
| SCHEMBL3569328 | 0.87 | ADORA1 (0.67) | ADORA1SLC6A3 | |
| SCHEMBL14748275 | 0.87 | ADORA1 (0.67) | ADORA1SLC6A3 | |
| SCHEMBL3576833 | 0.87 | ADORA1 (0.67) | ADORA1SLC6A3 | |
| SCHEMBL3576835 | 0.87 | ADORA1 (0.67) | ADORA1SLC6A3 |
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-2099788-B1 | CYCLICALLY SUBSTITUTED 3,5-DICYANO-2-THIOPYRIDINES AND USE THEREOF | BAYER IP GMBH (DE) | 2013-03-06 | — | — | EP | disclosed |