Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.59 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.59 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.59 |
| ▸ | ELAVL1 | Q15717 | 1/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | PDE5A | O76074 | 1/20 | 0.42 |
| ▸ | PDE1A | P54750 | 1/20 | 0.42 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.42 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.42 |
| ▸ | GHSR | Q92847 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.39 |
| ▸ | MAPT | P10636 | 6/20 | 0.39 |
| ▸ | MEN1 | O00255 | 5/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7013023 | 0.81 | ADORA3 (0.65) | ADORA3ADORA2AADORA2BELAVL1ADORA1 | |
| SCHEMBL28185528 | 0.81 | ADORA1 (0.52) | ADORA3ADORA2AADORA2BADORA1ALDH1A1 | |
| SCHEMBL4306407 | 0.80 | ADORA3 (0.64) | ADORA3ADORA2AADORA2BELAVL1ADORA1 | |
| SCHEMBL28325319 | 0.80 | KDM4E (0.56) | ADORA2AELAVL1ADORA1ALDH1A1KDM4E | |
| SCHEMBL28185532 | 0.79 | KDM4E (0.55) | ADORA3ADORA2AADORA2BELAVL1ADORA1 | |
| SCHEMBL28184877 | 0.78 | ADORA2A (0.54) | ADORA2AADORA1ALDH1A1KDM4EMEN1 | |
| SCHEMBL28184873 | 0.78 | KDM4E (0.54) | ADORA2AADORA1ALDH1A1KDM4EMAPT | |
| SCHEMBL13914391 | 0.76 | ADORA2B (0.73) | ADORA3ADORA2AADORA2BELAVL1ADORA1 | |
| SCHEMBL3556602 | 0.74 | ADORA2B (0.68) | ADORA3ADORA2AADORA2BELAVL1ADORA1 | |
| SCHEMBL13914390 | 0.74 | ADORA2B (0.77) | ADORA3ADORA2AADORA2BELAVL1ADORA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1407971-A | Substituted 2-thio-3,5-dicyano-4-aryl-6-aminopyridines and the use thereof | BAYER AG (DE) | 2003-04-02 | — | — | CN | disclosed |