Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 19/20 | 0.83 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL12923691 | 1.00 | ADORA2A (0.83) | ADORA2AADORA1NPC1RAB9A | |
| SCHEMBL22722588 | 1.00 | ADORA2A (0.83) | ADORA2AADORA1NPC1RAB9A | |
| SCHEMBL6883428 | 0.91 | ADORA2A (1.00) | ADORA2A | |
| SCHEMBL12923671 | 0.91 | ADORA2A (1.00) | ADORA2A | |
| SCHEMBL990513 | 0.91 | ADORA2A (1.00) | ADORA2A | |
| SCHEMBL991077 | 0.87 | ADORA2A (0.81) | ADORA2A | |
| SCHEMBL990483 | 0.86 | ADORA2A (0.75) | ADORA2A | |
| SCHEMBL18269264 | 0.86 | ADORA2A (0.75) | ADORA2A | |
| SCHEMBL990485 | 0.86 | ADORA2A (0.75) | ADORA2A | |
| SCHEMBL6876823 | 0.84 | ADORA2A (0.71) | ADORA2ANPC1RAB9A |
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 |