Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.61 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.61 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.61 |
| ▸ | PI4KA | P42356 | 1/20 | 0.56 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.56 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.56 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.56 |
| ▸ | AHCY | P23526 | 3/20 | 0.54 |
| ▸ | ADA | P00813 | 4/20 | 0.53 |
| ▸ | PDE2A | O00408 | 3/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | PDE4A | P27815 | 1/20 | 0.53 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.53 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.53 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL24539005 | 0.89 | ADORA2A (0.60) | ADORA2AADORA2BADORA1PI4KAPI4K2B | |
| SCHEMBL24420285 | 0.88 | AHCY (0.59) | ADORA2AADORA2BADORA1PI4KAPI4K2B | |
| SCHEMBL24082278 | 0.86 | ADORA2A (0.51) | ADORA2AADORA2BADORA1PI4KAPI4K2B | |
| SCHEMBL20058717 | 0.84 | CDK1 (0.57) | ADORA2AADORA2BADORA1AHCYADA | |
| SCHEMBL13770668 | 0.82 | ADORA2A (0.56) | ADORA2AADORA2BADORA1PI4KAPI4K2B | |
| SCHEMBL20059153 | 0.82 | CDK1 (0.46) | ADORA2AADORA2BADORA1PDE2APDE4D | |
| SCHEMBL24254534 | 0.81 | ADORA2A (0.53) | ADORA2AADORA2BADORA1PI4KAPI4K2B | |
| SCHEMBL17641488 | 0.80 | ADORA2A (0.56) | ADORA2AADORA2BADORA1PI4KAPI4K2B | |
| SCHEMBL21133230 | 0.80 | ADORA2A (0.39) | ADORA2AADORA2BADORA1AHCYADA | |
| SCHEMBL21999234 | 0.79 | AHCY (0.71) | ADORA2AADORA2BADORA1PI4KAPI4K2B |
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-2970358-B1 | 3'-DEOXY NUCLEOSIDES FOR THE TREATMENT OF HCV | IDENIX PHARMACEUTICALS LLC (US) | 2021-06-30 | — | — | EP | disclosed |