Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 11/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 2/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.39 |
| ▸ | PDE5A | O76074 | 1/20 | 0.39 |
| ▸ | PDE1A | P54750 | 1/20 | 0.39 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.39 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28214163 | 0.80 | CNR2 (0.43) | CNR2PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL28041632 | 0.78 | CNR2 (0.71) | YTHDC1CNR2CNR1 | |
| SCHEMBL28214101 | 0.76 | CNR2 (0.36) | CNR2ALDH1A1ADORA2A | |
| SCHEMBL28214100 | 0.75 | HTT (0.48) | ALDH1A1MAPK1ADORA2APDE4APDE4B | |
| SCHEMBL28214770 | 0.74 | HDAC6 (0.43) | — | |
| SCHEMBL28214165 | 0.72 | MET (0.45) | ALDH1A1MAPK1ADORA2APDE4APDE4B | |
| SCHEMBL28214704 | 0.69 | MEN1 (0.42) | ALDH1A1MAPK1ADORA2APDE4APDE4B | |
| Dimethylamine SCHEMBL4532702 | 0.68 | PDE4A (0.65) | YTHDC1CNR2ADORA2APDE4APDE4B | |
| SCHEMBL30441867 | 0.68 | IDO1 (0.48) | ALDH1A1 | |
| SCHEMBL8094241 | 0.68 | IDO1 (0.48) | ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105209466-B | purine derivatives as CB2 receptor agonists | 豪夫迈·罗氏有限公司 | 2018-05-18 | — | — | CN | claimed |
| CN-105209466-B | purine derivatives as CB2 receptor agonists | 豪夫迈·罗氏有限公司 | 2018-05-18 | — | — | CN | disclosed |