Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 13/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.39 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.35 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | ATR | Q13535 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28463384 | 0.81 | ADORA2A (0.55) | ADORA2AADORA1ADORA3ADORA2BBRD4 | |
| SCHEMBL29907659 | 0.80 | ADORA2A (0.56) | ADORA2AADORA1ADORA3ADORA2BCNR1 | |
| SCHEMBL29907672 | 0.78 | ADORA2A (0.51) | ADORA2AADORA1ADORA2BBRD4DYRK1A | |
| SCHEMBL22552045 | 0.77 | ADORA2A (0.47) | ADORA2AADORA1ADORA3KDM4EALDH1A1 | |
| SCHEMBL29907698 | 0.77 | ADORA2A (0.47) | ADORA2AADORA1ADORA3KDM4EALDH1A1 | |
| SCHEMBL22579112 | 0.75 | ADORA2A (0.49) | ADORA2AADORA1ADORA3KDM4EALDH1A1 | |
| SCHEMBL29907681 | 0.75 | ADORA2A (0.48) | ADORA2AADORA1ADORA2BDGAT1SOAT1 | |
| SCHEMBL22579156 | 0.73 | ADORA2A (0.48) | ADORA2AADORA1ADORA3ADORA2BBRD4 | |
| SCHEMBL13680725 | 0.72 | ADORA2A (0.51) | ADORA2AADORA1ADORA3KDM4EALDH1A1 | |
| SCHEMBL22579095 | 0.68 | ADORA2A (0.51) | ADORA2AADORA1ADORA3ADORA2BATR |
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-115181092-A | Pyrazine compounds and uses thereof | 迪哲(江苏)医药股份有限公司 | 2022-10-14 | — | — | CN | disclosed |
| CN-112279837-B | Pyrazine compounds and uses thereof | 迪哲(江苏)医药股份有限公司 | 2022-08-09 | — | — | CN | disclosed |