Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 18/20 | 0.66 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.65 |
| ▸ | RET | P07949 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7900475 | 0.92 | ADORA1 (0.78) | ADORA1SLC6A3RET | |
| SCHEMBL15501124 | 0.89 | ADORA1 (0.77) | ADORA1SLC6A3RET | |
| SCHEMBL1422919 | 0.88 | ADORA1 (0.71) | ADORA1SLC6A3 | |
| SCHEMBL7893973 | 0.87 | ADORA1 (0.59) | ADORA1SLC6A3 | |
| SCHEMBL1932981 | 0.86 | ADORA1 (0.85) | ADORA1SLC6A3 | |
| SCHEMBL7898774 | 0.85 | ADORA1 (0.57) | ADORA1SLC6A3RET | |
| SCHEMBL8011126 | 0.85 | ADORA1 (0.56) | ADORA1SLC6A3RET | |
| SCHEMBL8008750 | 0.85 | ADORA1 (0.65) | ADORA1SLC6A3RET | |
| SCHEMBL10195692 | 0.85 | ADORA1 (0.56) | ADORA1SLC6A3 | |
| SCHEMBL10195761 | 0.83 | ADORA1 (0.57) | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2235011-B1 | SUBSTITUTED PYRROLO[2, 3-B]AND PYRAZOLO[3, 4-B]PYRIDINES FOR USE AS ADENOSINE RECEPTOR LIGANDS | Bayer Pharma AG (DE) | 2012-01-25 | — | — | EP | disclosed |
| WO-2010086101-A1 | ALKYLAMINE-SUBSTITUTED DICYANOPYRIDINE AND AMINO ACID ESTER PRODRUGS THEREOF | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2010-08-05 | — | — | WO | disclosed |
| WO-2009143992-A1 | 2-ALKOXY-SUBSTITUTED DICYANOPYRIDINES AND USE THEREOF | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-12-03 | — | — | WO | disclosed |