Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 17/20 | 0.67 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL18269267 | 1.00 | ADORA2A (0.67) | ADORA2AADORA1HDAC1HDAC2NPC1 | |
| SCHEMBL6884053 | 1.00 | ADORA2A (0.67) | ADORA2AADORA1HDAC1HDAC2NPC1 | |
| SCHEMBL18271624 | 0.90 | ADORA2A (0.55) | ADORA2AADORA1HDAC1HDAC2NPC1 | |
| SCHEMBL6879384 | 0.87 | ADORA2A (0.68) | ADORA2A | |
| SCHEMBL18269272 | 0.87 | ADORA2A (0.68) | ADORA2A | |
| SCHEMBL6883946 | 0.87 | ADORA2A (0.71) | ADORA2AHDAC1HDAC2 | |
| SCHEMBL6885468 | 0.86 | ADORA2A (0.71) | ADORA2ANPC1RAB9A | |
| SCHEMBL6876823 | 0.86 | ADORA2A (0.71) | ADORA2ANPC1RAB9A | |
| SCHEMBL12923689 | 0.86 | ADORA2A (0.71) | ADORA2ANPC1RAB9A | |
| SCHEMBL7047131 | 0.84 | ADORA2A (0.69) | 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 |