Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.69 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.69 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.69 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.69 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.69 |
| ▸ | TSHR | P16473 | 3/20 | 0.56 |
| ▸ | SLC29A1 | Q99808 | 2/20 | 0.56 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.56 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL5391367 | 1.00 | ADORA3 (0.69) | ADORA3ADORA1ADORA2AADORA2BCYP2D6 | |
| SCHEMBL5399226 | 0.98 | ADORA1 (0.72) | ADORA3ADORA1ADORA2AADORA2BCYP2D6 | |
| SCHEMBL5391740 | 0.85 | TSHR (0.60) | ADORA3ADORA1ADORA2AADORA2BTSHR | |
| SCHEMBL14593728 | 0.85 | TSHR (0.60) | ADORA3ADORA1ADORA2AADORA2BTSHR | |
| SCHEMBL8606926 | 0.84 | ADORA3 (0.96) | ADORA3ADORA1ADORA2AADORA2BCYP2D6 | |
| SCHEMBL9791771 | 0.84 | ADORA3 (0.96) | ADORA3ADORA1ADORA2AADORA2BCYP2D6 | |
| SCHEMBL9791783 | 0.84 | ADORA3 (0.96) | ADORA3ADORA1ADORA2AADORA2BCYP2D6 | |
| SCHEMBL8606913 | 0.84 | ADORA3 (0.96) | ADORA3ADORA1ADORA2AADORA2BCYP2D6 | |
| SCHEMBL8606917 | 0.84 | ADORA3 (0.96) | ADORA3ADORA1ADORA2AADORA2BCYP2D6 | |
| SCHEMBL5391713 | 0.83 | ADORA2A (0.74) | ADORA3ADORA1ADORA2AADORA2BCYP2D6 |
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-7163928-B2 | Partial and full agonists of A1 adenosine receptors | CV THERAPEUTICS, INC. (US) | 2007-01-16 | — | — | US | disclosed |