Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 13/20 | 0.56 |
| ▸ | DDO | Q99489 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.44 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | THPO | P40225 | 1/20 | 0.44 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.44 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.44 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.44 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3361392 | 0.85 | DAO (0.62) | DAODDOKDM4EMEN1GRIN2D | |
| SCHEMBL14889487 | 0.78 | CSNK2A1 (0.48) | DAOKDM4EMEN1GRIN2DGRIN3B | |
| SCHEMBL791472 | 0.72 | GRIN2D (0.44) | DAOKDM4EMEN1GRIN2DGRIN3B | |
| SCHEMBL16767857 | 0.71 | DAO (1.00) | DAODDOGRIN2DGRIN3BGRIN1 | |
| SCHEMBL15690660 | 0.71 | DAO (0.64) | DAODDO | |
| SCHEMBL16767847 | 0.71 | DAO (1.00) | DAODDOGRIN2DGRIN3BGRIN1 | |
| SCHEMBL15690449 | 0.71 | DAO (0.64) | DAODDO | |
| SCHEMBL30638389 | 0.71 | ALDH1A1 (0.52) | KDM4EMEN1ALDH1A1LMNAMAPT | |
| SCHEMBL29140575 | 0.71 | ALDH1A1 (0.52) | KDM4EMEN1ALDH1A1LMNAMAPT | |
| SCHEMBL17601602 | 0.71 | MAOB (0.40) | KDM4EMEN1GRIN2DGRIN3BALDH1A1 |
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-113549010-B | Preparation and application of compound with AMPK (AMPK) agonistic activity and prodrug thereof | 中国科学院上海药物研究所 | 2023-10-20 | — | — | CN | disclosed |
| CN-113549010-A | Preparation and application of compound with AMPK agonistic activity and prodrug thereof | 中国科学院上海药物研究所 | 2021-10-26 | — | — | CN | disclosed |