Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 13/20 | 0.74 |
| ▸ | PDE4B | Q07343 | 13/20 | 0.74 |
| ▸ | PDE4C | Q08493 | 13/20 | 0.74 |
| ▸ | PDE4D | Q08499 | 13/20 | 0.74 |
| ▸ | ADORA2A | P29274 | 12/20 | 0.74 |
| ▸ | ADORA2B | P29275 | 10/20 | 0.74 |
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.74 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.57 |
| ▸ | BLM | P54132 | 1/20 | 0.57 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL9845195 | 0.92 | ADORA2A (0.75) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL4423680 | 0.85 | ADORA2B (1.00) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| 1-Methylxanthine SCHEMBL17748264 | 0.80 | ADORA2B (0.89) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL10181082 | 0.79 | PDE4A (0.74) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL27395394 | 0.77 | ADORA2B (1.00) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL6233166 | 0.77 | ADORA2B (1.00) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL8124420 | 0.77 | PDE4A (0.74) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL1892011 | 0.75 | ADORA2B (0.92) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL380135 | 0.75 | ADORA2A (1.00) | PDE4APDE4BPDE4CPDE4DADORA2A | |
| SCHEMBL27396492 | 0.75 | ADORA2A (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0417790-A2 | S-triazolo[3,4-i]purine derivatives | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1991-03-20 | — | — | EP | disclosed |