Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 1/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.47 |
| ▸ | TARBP2 | Q15633 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.46 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.45 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.45 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.45 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.45 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.44 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | AR | P10275 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1226662 | 0.90 | ADORA2B (0.62) | ADORA2BHTTTARBP2ADORA3MAPT | |
| SCHEMBL28484544 | 0.87 | ADORA2B (0.60) | ADORA2BADORA3MAPTPKMKDM4E | |
| SCHEMBL24494785 | 0.87 | ADORA2B (0.66) | ADORA2BHTTADORA3MAPTLMNA | |
| SCHEMBL28483524 | 0.85 | ADORA2B (0.58) | ADORA2BHTTADORA3MAPTLMNA | |
| SCHEMBL28479651 | 0.80 | ADORA2B (0.61) | ADORA2BHTTADORA3CACNA1FCACNA1D | |
| SCHEMBL28479412 | 0.80 | ADORA2B (0.61) | ADORA2BHTTADORA3MAPTLMNA | |
| SCHEMBL28477674 | 0.78 | ADORA2B (0.58) | ADORA2BADORA3MAPTLMNAKDM4E | |
| SCHEMBL6464508 | 0.77 | AR (0.67) | HTTSIRT2TARBP2MAPTPKM | |
| SCHEMBL28477630 | 0.76 | ADORA2B (0.56) | ADORA2BHTTMAPTPKMLMNA | |
| SCHEMBL2947850 | 0.75 | ADORA2B (0.61) | ADORA2BHTTADORA3MAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-111825622-A | Method for preparing 2-pyrimidone derivative by oxidative dehydrogenation aromatization | 西华大学 | 2020-10-27 | — | — | CN | disclosed |