Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.44 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.43 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.41 |
| ▸ | FLT4 | P35916 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 5/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28939426 | 0.80 | ADORA3 (0.43) | PIK3CD | |
| SCHEMBL28939516 | 0.77 | FLT4 (0.62) | ALDH1A1HSD17B10KDM4EHPGDTSHR | |
| SCHEMBL28939432 | 0.70 | HPGD (0.47) | ALDH1A1HSD17B10KDM4EHPGDTSHR | |
| SCHEMBL5348118 | 0.70 | ADORA2A (0.64) | KDM4E | |
| SCHEMBL13769935 | 0.69 | HSD17B10 (0.44) | ALDH1A1HSD17B10KDM4EHPGDTSHR | |
| SCHEMBL28963715 | 0.68 | GAA (0.42) | ALDH1A1HPGDTSHRMAPTMEN1 | |
| SCHEMBL7038766 | 0.68 | KDM4E (0.46) | ALDH1A1HSD17B10KDM4EHPGDTSHR | |
| SCHEMBL13769936 | 0.66 | PDE4B (0.42) | ALDH1A1HSD17B10KDM4EHPGDMAPT | |
| SCHEMBL23885041 | 0.64 | RAB9A (0.45) | ALDH1A1HSD17B10KDM4EHPGDTSHR | |
| SCHEMBL23885609 | 0.64 | RAB9A (0.45) | ALDH1A1HSD17B10KDM4EHPGDTSHR |
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 |