Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGK1 | P00558 | 3/20 | 0.64 |
| ▸ | PGK2 | P07205 | 3/20 | 0.64 |
| ▸ | ADORA2A | P29274 | 8/20 | 0.63 |
| ▸ | NT5E | P21589 | 2/20 | 0.61 |
| ▸ | ADORA3 | P0DMS8 | 7/20 | 0.59 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.59 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.59 |
| ▸ | THPO | P40225 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | ADORA2B | P29275 | 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 | |
|---|---|---|---|---|
| SCHEMBL7771098 | 1.00 | PGK1 (0.64) | PGK1PGK2ADORA2ANT5EADORA3 | |
| SCHEMBL7049149 | 0.90 | PGK1 (0.79) | PGK1PGK2ADORA2AADORA3ADORA1 | |
| SCHEMBL5694942 | 0.88 | ADORA2A (0.75) | ADORA2AADORA3ADORA1ADORA2B | |
| SCHEMBL5695147 | 0.88 | ADORA2A (0.75) | ADORA2AADORA3ADORA1ADORA2B | |
| SCHEMBL7777196 | 0.88 | ADORA2A (0.75) | ADORA2AADORA3ADORA1ADORA2B | |
| SCHEMBL5694965 | 0.87 | ADORA2A (0.58) | PGK1PGK2ADORA2ANT5EADORA3 | |
| SCHEMBL5694961 | 0.87 | ADORA2A (0.58) | PGK1PGK2ADORA2ANT5EADORA3 | |
| SCHEMBL5694960 | 0.87 | PGK1 (0.64) | PGK1PGK2ADORA2ANT5EADORA3 | |
| SCHEMBL5694954 | 0.87 | PGK1 (0.64) | PGK1PGK2ADORA2ANT5EADORA3 | |
| SCHEMBL5694948 | 0.86 | ADORA2A (0.81) | PGK1PGK2ADORA2ANT5EADORA3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1121372-B1 | ADENINE DERIVATIVES | PFIZER LTD (GB) | 2006-06-28 | — | — | EP | disclosed |
| US-6326359-B1 | PURINE DERIVATIVES | PFIZER INC | 2001-12-04 | — | — | US | disclosed |
| EP-1121372-A1 | ADENINE DERIVATIVES | Pfizer Limited (GB) | 2001-08-08 | — | — | EP | disclosed |
| WO-2000023457-A1 | ADENINE DERIVATIVES | PFIZER LIMITED (GB) | 2000-04-27 | — | — | WO | disclosed |