Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 3/20 | 0.56 |
| ▸ | RORB | Q92753 | 7/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.38 |
| ▸ | IKBKB | O14920 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | PTAFR | P25105 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4090647 | 0.86 | ADORA1 (0.46) | ADORA1RORBADORA2AIKBKBBRD4 | |
| SCHEMBL4080804 | 0.86 | ADORA1 (0.43) | ADORA1RORBADORA2AIKBKBBRD4 | |
| SCHEMBL4078130 | 0.82 | ADORA1 (0.40) | ADORA1RORBADORA2AIKBKBMAPT | |
| SCHEMBL4076829 | 0.79 | RORB (0.41) | ADORA1RORBIKBKBMAPTRORC | |
| SCHEMBL4085898 | 0.79 | ADORA1 (0.42) | ADORA1RORBADORA2AIKBKBBRD4 | |
| SCHEMBL3974618 | 0.79 | ADORA1 (0.44) | ADORA1RORBIKBKBMAPTCNR2 | |
| SCHEMBL3976889 | 0.79 | ADORA1 (0.46) | ADORA1RORBMAPTCNR2RORC | |
| SCHEMBL2478195 | 0.77 | RORC (0.50) | ADORA1RORBADORA2AMAPTCNR2 | |
| SCHEMBL28839039 | 0.73 | RORC (0.44) | ADORA1RORBADORA2AMAPTRORC | |
| SCHEMBL8881894 | 0.73 | RORB (0.44) | ADORA1RORBADORA2AIKBKBBRD4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009049362-A1 | A1 ADENOSINE RECEPTOR ALLOSTERIC ENHANCERS | MONASH UNIVERSITY (AU) | 2009-04-23 | — | — | WO | disclosed |