Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 18/20 | 0.37 |
| ▸ | PRNP | P04156 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3576171 | 0.89 | ADORA1 (0.41) | ADORA1PRNPRAB9ASLC6A3 | |
| SCHEMBL13550263 | 0.84 | ADORA1 (0.41) | ADORA1RAB9ASLC6A3 | |
| SCHEMBL3572737 | 0.84 | ADORA1 (0.51) | ADORA1SLC6A3 | |
| SCHEMBL3572722 | 0.79 | ADORA1 (0.50) | ADORA1SLC6A3 | |
| SCHEMBL3853833 | 0.79 | ADORA1 (0.44) | ADORA1SLC6A3 | |
| SCHEMBL3845090 | 0.79 | ADORA1 (0.44) | ADORA1SLC6A3 | |
| SCHEMBL13550056 | 0.77 | ADORA1 (0.49) | ADORA1SLC6A3 | |
| SCHEMBL3580448 | 0.74 | ADORA1 (0.62) | ADORA1SLC6A3 | |
| SCHEMBL3846615 | 0.74 | ADORA1 (0.62) | ADORA1SLC6A3 | |
| SCHEMBL3574634 | 0.72 | ADORA1 (0.49) | ADORA1RAB9ASLC6A3 |
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 |