Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR7 | Q9NYK1 | 6/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | NUDT1 | P36639 | 2/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | DAPK1 | P53355 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28939428 | 0.89 | MAPK1 (0.44) | LMNAHPGDADORA2AADORA1DAPK1 | |
| SCHEMBL28939432 | 0.89 | HPGD (0.47) | ALDH1A1LMNATSHRHTTHPGD | |
| SCHEMBL28939430 | 0.87 | HPGD (0.41) | TLR7HPGDADORA2AADORA1 | |
| SCHEMBL28939435 | 0.83 | DAPK1 (0.45) | ALDH1A1LMNATSHRHTTHPGD | |
| SCHEMBL28963610 | 0.79 | SCN9A (0.42) | HPGDADORA2AADORA1 | |
| SCHEMBL28963715 | 0.76 | GAA (0.42) | ALDH1A1LMNATSHRHPGDGAA | |
| SCHEMBL510344 | 0.72 | TLR7 (0.74) | TLR7NUDT1 | |
| SCHEMBL509431 | 0.70 | TLR7 (0.72) | TLR7NUDT1 | |
| 9-Benzyl-6-Methoxy-9H-Purine SCHEMBL28939425 | 0.70 | HPGD (0.77) | LMNASMN1; SMN2HTTHPGDADORA2A | |
| SCHEMBL28939426 | 0.69 | ADORA3 (0.43) | ADORA2AADORA1 |
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-114524815-B | 8-alkoxypurine derivative and preparation method and application thereof | 华南理工大学 | 2023-05-23 | — | — | CN | disclosed |
| CN-114524815-A | 8-alkoxy purine derivative and preparation method and application thereof | 华南理工大学 | 2022-05-24 | — | — | CN | disclosed |