Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAPK1 | P53355 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | FLT4 | P35916 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28939432 | 0.89 | HPGD (0.47) | DAPK1HPGDADORA2AADORA1FLT4 | |
| SCHEMBL28939434 | 0.83 | TLR7 (0.45) | DAPK1HPGDADORA2AADORA1LMNA | |
| SCHEMBL28939428 | 0.82 | MAPK1 (0.44) | DAPK1HPGDADORA2AADORA1FLT4 | |
| SCHEMBL28939430 | 0.81 | HPGD (0.41) | HPGDADORA2AADORA1 | |
| SCHEMBL28963610 | 0.79 | SCN9A (0.42) | HPGDADORA2AADORA1PIK3CD | |
| SCHEMBL28963715 | 0.76 | GAA (0.42) | HPGDMEN1KMT2ALMNATSHR | |
| SCHEMBL31321967 | 0.74 | DAPK1 (0.47) | DAPK1HPGDADORA2AADORA1MEN1 | |
| SCHEMBL30983891 | 0.71 | DAPK1 (0.43) | DAPK1HPGDADORA2AADORA1KDR | |
| 9-Benzyl-6-Methoxy-9H-Purine SCHEMBL28939425 | 0.70 | HPGD (0.77) | DAPK1HPGDADORA2AFLT4KDR | |
| SCHEMBL28939426 | 0.69 | ADORA3 (0.43) | ADORA2AADORA1PIK3CD |
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 |