Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 16/20 | 0.53 |
| ▸ | USP19 | O94966 | 1/20 | 0.39 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12923690 | 1.00 | ADORA2A (0.53) | ADORA2AUSP19NTRK1HSD11B1AVPR2 | |
| SCHEMBL6886980 | 0.86 | ADORA2A (0.69) | ADORA2A | |
| SCHEMBL6877097 | 0.83 | ADORA2A (0.69) | ADORA2A | |
| SCHEMBL12923689 | 0.82 | ADORA2A (0.71) | ADORA2A | |
| SCHEMBL6876823 | 0.82 | ADORA2A (0.71) | ADORA2A | |
| SCHEMBL6885468 | 0.82 | ADORA2A (0.71) | ADORA2A | |
| SCHEMBL6885255 | 0.79 | ADORA2A (0.70) | ADORA2A | |
| SCHEMBL6886204 | 0.78 | ADORA2A (0.74) | ADORA2A | |
| SCHEMBL6886136 | 0.78 | ADORA2A (0.72) | ADORA2A | |
| SCHEMBL6885002 | 0.77 | ADORA2A (0.73) | ADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| US-6689790-B2 | 8-AMINO-6-AMIDO-SUBSTITUTED-(1,2,4)TRIAZOLO(1,5-A)PYRIDINES; ADENOSINE RECEPTOR MODULATERS | HOFFMANN-LA ROCHE INC. | 2004-02-10 | — | — | US | disclosed |