Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 8/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 8/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 8/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.34 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.33 |
| ▸ | HINT1 | P49773 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.32 |
| ▸ | NT5E | P21589 | 3/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5492971 | 0.87 | NT5E (0.38) | ADORA3ADORA2BADORA1ADORA2AHSP90B1 | |
| SCHEMBL9791026 | 0.85 | ADORA3 (0.35) | ADORA3ADORA2BADORA1ADORA2AHSP90B1 | |
| SCHEMBL8587367 | 0.83 | ADORA2A (0.41) | ADORA3ADORA2BADORA1ADORA2AHSP90B1 | |
| SCHEMBL8588710 | 0.82 | ADORA3 (0.38) | ADORA3ADORA2BADORA1ADORA2AHSP90B1 | |
| SCHEMBL8588424 | 0.82 | ADORA3 (0.42) | ADORA3ADORA2BADORA1ADORA2AHSP90B1 | |
| SCHEMBL1120685 | 0.80 | HINT1 (0.43) | ADORA3HINT1 | |
| SCHEMBL30544925 | 0.79 | ADORA2A (0.49) | ADORA3ADORA2BADORA1ADORA2AHSP90B1 | |
| SCHEMBL4948918 | 0.79 | LMNA (0.43) | ADORA3ADORA2BADORA1ADORA2ANT5E | |
| SCHEMBL1433825 | 0.78 | DNMT1 (0.39) | — | |
| SCHEMBL5498228 | 0.78 | LMNA (0.37) | ADORA3ADORA2BADORA1ADORA2ANT5E |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992001456-A1 | HETEROCYCLIC COMPOUNDS | THE WELLCOME FOUNDATION LIMITED (GB) | 1992-02-06 | — | — | WO | claimed |
| WO-1998042352-A1 | METHOD FOR TREATING B-CELL TUMORS WITH ARA-G NUCLEOSIDE DERIVATIVES | GLAXO GROUP LTD. (GB) | 1998-10-01 | — | — | WO | disclosed |
| WO-1992001456-A1 | HETEROCYCLIC COMPOUNDS | THE WELLCOME FOUNDATION LIMITED (GB) | 1992-02-06 | — | — | WO | disclosed |