Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 4/20 | 0.51 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.51 |
| ▸ | POLB | P06746 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL22552109 | 1.00 | ADORA2A (0.51) | ADORA2AADORA1POLBTSHRALDH1A1 | |
| SCHEMBL17769154 | 0.88 | HPGD (0.50) | ADORA2AADORA1POLBTSHRALDH1A1 | |
| SCHEMBL29906679 | 0.87 | ADORA2A (0.65) | ADORA2AADORA1POLBTSHRALDH1A1 | |
| SCHEMBL22552079 | 0.87 | ADORA2A (0.65) | ADORA2AADORA1POLBTSHRALDH1A1 | |
| SCHEMBL22552137 | 0.85 | ADORA2A (0.47) | ADORA2AADORA1POLBTSHRALDH1A1 | |
| SCHEMBL29907519 | 0.85 | ADORA2A (0.47) | ADORA2AADORA1POLBTSHRALDH1A1 | |
| SCHEMBL22552131 | 0.82 | ADORA2A (0.51) | ADORA2AADORA1POLBTSHRALDH1A1 | |
| SCHEMBL29907526 | 0.82 | ADORA2A (0.51) | ADORA2AADORA1POLBTSHRALDH1A1 | |
| SCHEMBL17778206 | 0.76 | ADORA2A (0.48) | ADORA2AADORA1POLBTSHRALDH1A1 | |
| SCHEMBL17768953 | 0.76 | ADORA2A (0.54) | ADORA2AADORA1ADORA2BMAPK1HDAC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115181092-B | Pyrazine compounds and uses thereof | 迪哲(江苏)医药股份有限公司 | 2024-05-03 | — | — | CN | disclosed |
| 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 |