Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 14/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 13/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 7/20 | 0.42 |
| ▸ | HTR2C | P28335 | 6/20 | 0.42 |
| ▸ | HTR2B | P41595 | 6/20 | 0.42 |
| ▸ | TMIGD3 | P0DMS9 | 3/20 | 0.42 |
| ▸ | TSPO | P30536 | 2/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.41 |
| ▸ | HRH2 | P25021 | 1/20 | 0.39 |
| ▸ | HTR5A | P47898 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.37 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL242510 | 1.00 | ADORA1 (0.42) | ADORA1ADORA3ADORA2AHTR2CHTR2B | |
| SCHEMBL588937 | 0.83 | ADORA3 (0.53) | ADORA1ADORA3ADORA2AADORA2B | |
| SCHEMBL240045 | 0.83 | ADORA3 (0.46) | ADORA1ADORA3ADORA2AHTR2CHTR2B | |
| SCHEMBL4220375 | 0.83 | ADORA3 (0.46) | ADORA1ADORA3ADORA2AHTR2CHTR2B | |
| SCHEMBL14018046 | 0.81 | HTR2C (0.40) | ADORA1ADORA3ADORA2AHTR2CHTR2B | |
| SCHEMBL1908715 | 0.80 | HTR2C (0.41) | ADORA1ADORA3ADORA2AHTR2CHTR2B | |
| SCHEMBL241618 | 0.80 | LMNA (0.46) | ADORA1ADORA3ADORA2AHTR2CHTR2B | |
| SCHEMBL242801 | 0.78 | ADORA1 (0.37) | ADORA1ADORA3ADORA2AHTR2CHTR2B | |
| SCHEMBL1412357 | 0.75 | ADORA3 (0.39) | ADORA1ADORA3ADORA2AHTR2CHTR2B | |
| SCHEMBL242153 | 0.74 | ADORA2A (0.49) | ADORA1ADORA3ADORA2AHTR2CHTR2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-2292619-A1 | Purine derivatives for use as adenonsin A-2A receptor agonists | Novartis AG (CH) | 2011-03-09 | — | — | EP | disclosed |