Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 9/20 | 0.53 |
| ▸ | AGER | Q15109 | 5/20 | 0.51 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.45 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | THPO | P40225 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28937328 | 0.89 | AGER (0.51) | ADORA3AGERADORA2AADORA2BADORA1 | |
| SCHEMBL28963348 | 0.89 | AGER (0.64) | ADORA3AGERADORA2AADORA2BADORA1 | |
| SCHEMBL28937336 | 0.85 | AGER (0.53) | ADORA3AGERADORA2AADORA2BADORA1 | |
| SCHEMBL30174339 | 0.83 | AGER (0.68) | AGER | |
| SCHEMBL28963347 | 0.82 | AGER (0.47) | ADORA3AGERADORA2A | |
| SCHEMBL28937340 | 0.81 | AGER (0.61) | AGERPTGS2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL30174333 | 0.81 | AGER (0.62) | ADORA3AGERADORA2AADORA2BADORA1 | |
| SCHEMBL30174334 | 0.79 | AGER (0.52) | ADORA3AGERADORA2AADORA2BADORA1 | |
| SCHEMBL28937339 | 0.79 | ADORA3 (0.52) | ADORA3AGERADORA2AADORA1HDAC1 | |
| SCHEMBL28937343 | 0.78 | LTA4H (0.50) | ADORA3AGERADORA2AADORA2BADORA1 |
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-119350257-A | Triazole compounds | 广西医科大学 | 2025-01-24 | — | — | CN | disclosed |
| CN-115594642-B | A Ji Ruige triazole derivative and application thereof in resisting breast cancer | 广西医科大学 | 2024-12-27 | — | — | CN | disclosed |
| CN-115594642-A | Az Ji Ruige triazole derivative and application thereof in resisting breast cancer | 广西医科大学（CN） | 2023-01-13 | — | — | CN | disclosed |