Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 1/20 | 0.59 |
| ▸ | PDE1A | P54750 | 1/20 | 0.59 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.59 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.59 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.54 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.54 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.54 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.51 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.51 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL9430566 | 0.96 | PDE2A (0.56) | PDE2APDE1APDE1BPDE1CSIRT1 | |
| SCHEMBL10855561 | 0.90 | PDE2A (0.73) | PDE2APDE1APDE1BPDE1CSIRT1 | |
| SCHEMBL1063544 | 0.88 | SIRT1 (0.68) | SIRT1SIRT3SIRT5ADORA1ADORA2A | |
| SCHEMBL9429916 | 0.83 | PDE2A (0.53) | PDE2APDE1APDE1BPDE1CSIRT1 | |
| SCHEMBL10859893 | 0.82 | SIRT1 (0.61) | SIRT1SIRT3SIRT5ADORA1ADORA2A | |
| SCHEMBL10856971 | 0.82 | SIRT1 (0.61) | SIRT1SIRT3SIRT5ADORA1ADORA2A | |
| SCHEMBL9430619 | 0.82 | ADORA2A (0.61) | SIRT1SIRT3SIRT5ADORA1ADORA2A | |
| SCHEMBL4623475 | 0.81 | PDE1A (0.71) | PDE2APDE1APDE1BPDE1CSIRT1 | |
| SCHEMBL9430131 | 0.81 | ADORA2A (0.56) | SIRT1SIRT3SIRT5ADORA1ADORA2A | |
| SCHEMBL9430769 | 0.80 | ADORA2A (0.55) | SIRT1SIRT3SIRT5ADORA1ADORA2A |
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-0001735-B1 | XANTHINE DERIVATIVES HAVING ANTIALLERGIC ACTIVITY AND PHARMACOLOGICAL PREPARATIONS CONTAINING THEM | Aktiebolaget DRACO (SE) | 1982-09-01 | — | — | EP | disclosed |