Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 15/20 | 0.70 |
| ▸ | PDE4B | Q07343 | 15/20 | 0.70 |
| ▸ | PDE4C | Q08493 | 15/20 | 0.70 |
| ▸ | PDE4D | Q08499 | 15/20 | 0.70 |
| ▸ | ADORA2A | P29274 | 11/20 | 0.70 |
| ▸ | ADORA2B | P29275 | 8/20 | 0.68 |
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 | |
|---|---|---|---|---|
| SCHEMBL11080222 | 0.99 | PDE4A (0.68) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL11153561 | 0.96 | ADORA2B (0.76) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL7094603 | 0.92 | PDE4A (0.75) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL11489193 | 0.87 | PDE4A (0.56) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL3186630 | 0.85 | PDE4A (0.94) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL11361392 | 0.84 | PDE4A (0.91) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL3190853 | 0.82 | ADORA2B (0.92) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL21381259 | 0.82 | PDE4A (1.00) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL21381240 | 0.82 | ADORA2B (0.94) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL3842077 | 0.82 | PDE4A (1.00) | PDE4APDE4BPDE4CPDE4DADORA2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4454138-A | TREATMENT OF VASCULAR DISEASES | Wuelfing, Johann A. (DE) | 1984-06-12 | — | — | US | disclosed |
| EP-0018136-B1 | XANTHINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS | BEECHAM - WUELFING GmbH & Co. KG (DE) | 1983-11-16 | — | — | EP | disclosed |
| EP-0018136-A1 | Xanthine derivatives, a process for their preparation and their use in pharmaceutical compositions | BEECHAM - WUELFING GmbH & Co. KG (DE) | 1980-10-29 | — | — | EP | disclosed |