Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 13/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 7/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL240135 | 1.00 | ADORA2A (0.42) | ADORA2AADORA3ADORA1EPHX2NPY5R | |
| SCHEMBL240134 | 1.00 | ADORA2A (0.42) | ADORA2AADORA3ADORA1EPHX2NPY5R | |
| SCHEMBL1836813 | 0.95 | ADORA2A (0.37) | ADORA2AADORA3ADORA1EPHX2 | |
| SCHEMBL1836815 | 0.95 | ADORA2A (0.37) | ADORA2AADORA3ADORA1EPHX2 | |
| SCHEMBL241755 | 0.95 | ADORA2A (0.37) | ADORA2AADORA3ADORA1EPHX2 | |
| SCHEMBL241754 | 0.95 | ADORA2A (0.37) | ADORA2AADORA3ADORA1EPHX2 | |
| SCHEMBL10158632 | 0.92 | ADORA2A (0.48) | ADORA2AADORA3ADORA1 | |
| SCHEMBL10158699 | 0.88 | ADORA2A (0.45) | ADORA2AADORA3ADORA1 | |
| SCHEMBL244527 | 0.88 | CA12 (0.43) | ADORA2AADORA3ADORA1 | |
| SCHEMBL244528 | 0.88 | CA12 (0.43) | ADORA2AADORA3ADORA1 |
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-2322525-A1 | Purine derivatives for use as adenosin A2A receptor agonists | Novartis AG (CH) | 2011-05-18 | — | — | EP | disclosed |