Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 4/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SLC29A1 | Q99808 | 5/20 | 0.34 |
| ▸ | ADA | P00813 | 1/20 | 0.34 |
| ▸ | PGK1 | P00558 | 1/20 | 0.33 |
| ▸ | PGK2 | P07205 | 1/20 | 0.33 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.33 |
| ▸ | AHCY | P23526 | 1/20 | 0.33 |
| ▸ | HINT1 | P49773 | 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 | |
|---|---|---|---|---|
| SCHEMBL18877204 | 0.92 | ADORA2A (0.41) | ADORA2AADORA3ADORA1ADORA2BCYP2C19 | |
| SCHEMBL16374064 | 0.92 | ADORA2A (0.41) | ADORA2AADORA3ADORA1ADORA2BCYP2C19 | |
| SCHEMBL16368166 | 0.92 | ADORA2A (0.41) | ADORA2AADORA3ADORA1ADORA2BCYP2C19 | |
| SCHEMBL16367936 | 0.81 | ADORA2A (0.36) | ADORA2AADORA3ADORA1ADORA2BADA | |
| SCHEMBL22474872 | 0.81 | ADORA2A (0.37) | ADORA2AADORA3ADORA1ADORA2BCYP2C19 | |
| SCHEMBL16647595 | 0.81 | ADORA2A (0.39) | ADORA2AADORA3ADORA1ADORA2BCYP2C19 | |
| SCHEMBL17378516 | 0.80 | ADORA2A (0.43) | ADORA2AADORA3ADORA1ADORA2BCYP2C19 | |
| SCHEMBL31228203 | 0.80 | ADORA2A (0.39) | ADORA2AADORA3ADORA1ADORA2BCYP2C19 | |
| SCHEMBL31228544 | 0.79 | ADORA2A (0.39) | ADORA2AADORA3ADORA1ADORA2BCYP2C19 | |
| SCHEMBL19590169 | 0.79 | ADORA2A (0.38) | ADORA2AADORA3ADORA1ADORA2BCYP2C19 |
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-9815864-B2 | Substituted nucleosides, nucleotides and analogs thereof | ALIOS BIOPHARMA, INC. (US) | 2017-11-14 | — | — | US | disclosed |