Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXFP1 | Q9HBX9 | 6/20 | 0.67 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.52 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.51 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL30810227 | 1.00 | RXFP1 (0.67) | RXFP1ADORA2BLMNATBXAS1PDE3A | |
| SCHEMBL28547018 | 0.84 | RXFP1 (0.74) | RXFP1ADORA2BLMNAPDE3AALDH1A1 | |
| SCHEMBL28551846 | 0.82 | ADORA2B (0.58) | RXFP1ADORA2BLMNATBXAS1PDE3A | |
| SCHEMBL30810148 | 0.82 | ADORA2B (0.58) | RXFP1ADORA2BLMNATBXAS1PDE3A | |
| SCHEMBL30810165 | 0.80 | KDM4E (0.54) | RXFP1ADORA2BALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL28557871 | 0.80 | KDM4E (0.54) | RXFP1ADORA2BALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL7141074 | 0.78 | RXFP1 (0.73) | RXFP1ADORA2BLMNAPDE3AALDH1A1 | |
| SCHEMBL11380427 | 0.76 | RXFP1 (0.55) | RXFP1ADORA2BLMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL11380423 | 0.76 | RXFP1 (0.55) | RXFP1ADORA2BLMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL11382728 | 0.74 | ADORA2B (0.56) | RXFP1ADORA2BLMNAALDH1A1SMN1; SMN2 |
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-112500413-B | Xanthine aromatic acid ether derivatives, preparation method and application thereof | 安徽中医药大学 | 2024-03-01 | — | — | CN | disclosed |
| CN-112500413-A | Xanthine aromatic acid ether derivatives and application thereof | 安徽中医药大学 | 2021-03-16 | — | — | CN | disclosed |