Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 7/20 | 0.54 |
| ▸ | PDE4A | P27815 | 3/20 | 0.54 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.54 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.54 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | ADORA2B | P29275 | 5/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
| ▸ | BRD2 | P25440 | 1/20 | 0.46 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.46 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL190990 | 0.83 | ADORA2A (0.59) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7026735 | 0.82 | SIRT1 (0.51) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4626790 | 0.79 | ADORA2A (0.58) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL3178085 | 0.79 | ADORA2A (0.58) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL13343375 | 0.79 | ADORA2A (0.55) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7621629 | 0.78 | ADORA2B (0.57) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL13368751 | 0.78 | ADORA2A (0.53) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL3848060 | 0.78 | ADORA2A (0.57) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL19066311 | 0.77 | ADORA2A (0.56) | ADORA2APDE4APDE4BPDE4CPDE4D | |
| SCHEMBL14796914 | 0.77 | ADORA2A (0.56) | ADORA2APDE4APDE4BPDE4CPDE4D |
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 |
|---|---|---|---|---|---|---|---|
| EP-1030666-A4 | NOVEL USE OF COMPOUNDS FOR ANTI-PRURITIC ACTIVITY | SMITHKLINE BEECHAM (US) | 2002-10-16 | — | — | EP | disclosed |
| EP-1030666-A1 | NOVEL USE OF COMPOUNDS FOR ANTI-PRURITIC ACTIVITY | Smithkline Beecham (US) | 2000-08-30 | — | — | EP | disclosed |
| WO-1999020280-A1 | NOVEL USE OF COMPOUNDS FOR ANTI-PRURITIC ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 1999-04-29 | — | — | WO | disclosed |