Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 8/20 | 0.54 |
| ▸ | ADORA2A | P29274 | 7/20 | 0.54 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.54 |
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.54 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.54 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.54 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.54 |
| ▸ | SLC22A11 | Q9NSA0 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.35 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.35 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7671402 | 0.91 | ADORA1 (0.50) | ADORA2BADORA2AADORA1ADORA3SLC6A3 | |
| SCHEMBL8203454 | 0.78 | ADORA1 (0.80) | ADORA2BADORA2AADORA1ADORA3SLC6A3 | |
| SCHEMBL8203432 | 0.76 | ADORA1 (0.78) | ADORA2BADORA2AADORA1ADORA3SLC6A3 | |
| SCHEMBL7269103 | 0.76 | ADORA1 (0.81) | ADORA2BADORA2AADORA1ADORA3SLC6A3 | |
| SCHEMBL7666682 | 0.74 | ADORA3 (0.50) | ADORA2BADORA2AADORA1ADORA3MEN1 | |
| SCHEMBL14051422 | 0.73 | ADORA1 (0.91) | ADORA2BADORA2AADORA1ADORA3SLC6A3 | |
| SCHEMBL7670431 | 0.73 | ADORA2B (0.54) | ADORA2BADORA2AADORA1ADORA3MEN1 | |
| SCHEMBL7666680 | 0.73 | ADORA3 (0.47) | ADORA2BADORA2AADORA1ADORA3MEN1 | |
| SCHEMBL7659412 | 0.72 | ADORA2B (0.45) | ADORA2BADORA2AADORA1ADORA3MEN1 | |
| SCHEMBL6999142 | 0.72 | SIRT1 (0.46) | ADORA2BADORA2AADORA1ADORA3MEN1 |
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-6492377-B1 | Imidazotriazolopyrimidines with adenosine-antagonistic activity | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2002-12-10 | — | — | US | disclosed |