Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 5/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.46 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | PI4KA | P42356 | 1/20 | 0.36 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.36 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.36 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.36 |
| ▸ | TLR7 | Q9NYK1 | 4/20 | 0.35 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | PDE8B | O95263 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28734054 | 0.80 | ADORA2A (0.42) | ADORA2AADORA1ADORA2BADORA3PI4KA | |
| SCHEMBL28734047 | 0.79 | ADORA2A (0.41) | ADORA2AADORA1ADORA2BADORA3PI4KA | |
| SCHEMBL3661591 | 0.73 | GPR84 (0.46) | ADORA2AADORA1ADORA2BADORA3PI4KA | |
| SCHEMBL7777421 | 0.72 | DHFR (0.46) | ADORA2API4KAPI4K2BPI4K2API4KB | |
| SCHEMBL10849861 | 0.72 | DHFR (0.46) | ADORA2API4KAPI4K2BPI4K2API4KB | |
| SCHEMBL92739 | 0.71 | KCNH2 (0.46) | ADORA2AADORA1ADORA2BADORA3CASP1 | |
| SCHEMBL1639952 | 0.70 | CASP1 (0.68) | ADORA2AADORA1ADORA2BADORA3TLR7 | |
| SCHEMBL30808296 | 0.69 | ADORA2A (0.40) | ADORA2AADORA1ADORA2BADORA3PI4KA | |
| SCHEMBL28299226 | 0.69 | POLA1 (0.53) | ADORA2AADORA3PI4KAPI4K2BPI4K2A | |
| SCHEMBL4551801 | 0.69 | ADORA2A (0.44) | ADORA2AADORA1ADORA2BADORA3PI4KA |
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-4621085-A | ANTIARRHYTHMIA AGENTS | ROHM GMBH CHEMISCHE FABRIK (DE) | 1986-11-04 | — | — | US | disclosed |