Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 4/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7486137 | 0.88 | ADORA2A (0.54) | ADORA2A | |
| SCHEMBL7709143 | 0.86 | RXRA (0.44) | ADORA2AALDH1A1HPGDADORA1 | |
| SCHEMBL7708407 | 0.85 | ADORA2A (0.53) | ADORA2AALDH1A1 | |
| SCHEMBL7483393 | 0.84 | ADORA2A (0.54) | ADORA2A | |
| SCHEMBL7487423 | 0.84 | ADORA2A (0.56) | ADORA2A | |
| SCHEMBL7489489 | 0.83 | ADORA2A (0.58) | ADORA2A | |
| SCHEMBL7485299 | 0.81 | ADORA2A (0.56) | ADORA2A | |
| SCHEMBL7711774 | 0.81 | ADORA2A (0.56) | ADORA2AADORA1 | |
| SCHEMBL14566165 | 0.81 | ADORA2A (0.53) | ADORA2AADORA1 | |
| SCHEMBL7486668 | 0.81 | ADORA2A (0.52) | ADORA2AALDH1A1 |
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-6355653-B1 | DRUG AND CARRIER FOR ANTIALLERGENS, BRAIN DISORDERS AND NEUROTRANSMITTERS | HOFFMANN-LA ROCHE INC. | 2002-03-12 | — | — | US | disclosed |