Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 18/20 | 0.58 |
| ▸ | RET | P07949 | 1/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.48 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL13913599 | 0.89 | ADORA1 (0.73) | ADORA1ADORA3ADORA2AADORA2BMEN1 | |
| SCHEMBL13913642 | 0.88 | ADORA1 (0.58) | ADORA1RETADORA3ADORA2AADORA2B | |
| SCHEMBL13913689 | 0.88 | ADORA1 (0.70) | ADORA1RETADORA3ADORA2AADORA2B | |
| SCHEMBL13913718 | 0.87 | KDM4E (0.60) | ADORA1RETMEN1ALDH1A1ALOX15 | |
| SCHEMBL13913635 | 0.84 | ADORA1 (0.79) | ADORA1ADORA3ADORA2B | |
| SCHEMBL13913981 | 0.82 | ADORA1 (0.56) | ADORA1ADORA3ADORA2AADORA2BALDH1A1 | |
| SCHEMBL13913547 | 0.82 | ADORA1 (0.71) | ADORA1ADORA3ADORA2AADORA2BMEN1 | |
| SCHEMBL13925963 | 0.82 | ADORA1 (0.62) | ADORA1ADORA3ADORA2AADORA2BMEN1 | |
| SCHEMBL13913630 | 0.81 | ADORA1 (0.71) | ADORA1MEN1ALDH1A1ALOX15KMT2A | |
| SCHEMBL13913789 | 0.81 | ADORA1 (0.71) | ADORA1RETMEN1ALDH1A1ALOX15 |
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 |