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 | |
|---|---|---|---|---|
| SCHEMBL13937951 | 0.91 | ADORA1 (0.66) | ADORA1SLC6A3 | |
| SCHEMBL15501129 | 0.91 | ADORA1 (0.66) | ADORA1SLC6A3 | |
| Hydrochloric Acid SCHEMBL15641612 | 0.90 | ADORA1 (0.65) | ADORA1SLC6A3 | |
| Hydrochloric Acid SCHEMBL15641615 | 0.90 | ADORA1 (0.65) | ADORA1SLC6A3 | |
| SCHEMBL13261044 | 0.86 | ADORA1 (0.53) | ADORA1SLC6A3 | |
| SCHEMBL7904995 | 0.86 | ADORA1 (0.62) | ADORA1SLC6A3 | |
| SCHEMBL13937448 | 0.84 | ADORA1 (0.57) | ADORA1SLC6A3 | |
| SCHEMBL13937436 | 0.84 | ADORA1 (0.57) | ADORA1SLC6A3 | |
| SCHEMBL15501125 | 0.84 | ADORA1 (0.57) | ADORA1SLC6A3 | |
| SCHEMBL15701261 | 0.83 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2743270-B1 | Alkylamino-substituted dicyanopyridines and their amino acid ester prodrugs | BAYER IP GMBH (DE) | 2016-12-21 | — | — | EP | disclosed |
| EP-2743270-A1 | Alkylamino-substituted dicyanopyridines and their amino acid ester prodrugs | Bayer Intellectual Property GmbH (DE) | 2014-06-18 | — | — | EP | disclosed |
| EP-2391620-B1 | ALKYLAMINE-SUBSTITUTED DICYANOPYRIDINE AND AMINO ACID ESTER PRODRUGS THEREOF | BAYER IP GMBH (DE) | 2014-05-07 | — | — | EP | disclosed |
| WO-2010086101-A1 | ALKYLAMINE-SUBSTITUTED DICYANOPYRIDINE AND AMINO ACID ESTER PRODRUGS THEREOF | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2010-08-05 | — | — | WO | disclosed |