Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 9/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 8/20 | 0.50 |
| ▸ | PDE4A | P27815 | 4/20 | 0.50 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.50 |
| ▸ | PDE4C | Q08493 | 4/20 | 0.50 |
| ▸ | PDE4D | Q08499 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL836600 | 0.83 | CYP1A2 (0.47) | ADORA2BADORA2APDE4APDE4BPDE4C | |
| SCHEMBL16028356 | 0.80 | TRPC5 (0.54) | ADORA2BADORA2APDE4APDE4BPDE4C | |
| SCHEMBL836842 | 0.78 | CYP1A2 (0.53) | ADORA2BADORA2APDE4APDE4BPDE4C | |
| SCHEMBL16027932 | 0.75 | CYP1A2 (0.44) | ADORA2BADORA2APDE4APDE4BPDE4C | |
| SCHEMBL3115778 | 0.74 | CYP1A2 (0.52) | ADORA2BADORA2APDE4APDE4BPDE4C | |
| SCHEMBL16028494 | 0.72 | ADORA3 (0.58) | ADORA2BADORA2AADORA3 | |
| SCHEMBL16028059 | 0.72 | TRPC5 (0.54) | CYP1A2CYP2C19CYP3A4ADORA3 | |
| SCHEMBL16028583 | 0.71 | TRPC5 (0.59) | ADORA2BADORA2APDE4APDE4BPDE4C | |
| SCHEMBL16027836 | 0.71 | PCSK9 (0.48) | CYP1A2CYP2C19CYP3A4ADORA3 | |
| SCHEMBL9430619 | 0.69 | ADORA2A (0.61) | ADORA2BADORA2APDE4APDE4BPDE4C |
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-2970303-B3 | SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF | HYDRA BIOSCIENCES INC (US) | 2018-08-01 | — | — | EP | disclosed |