Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 5/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | DDO | Q99489 | 1/20 | 0.36 |
| ▸ | PADI4 | Q9UM07 | 3/20 | 0.33 |
| ▸ | XDH | P47989 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30826139 | 1.00 | DAO (0.41) | DAOPARP1DDOPADI4XDH | |
| SCHEMBL7554127 | 0.77 | KDM4E (0.42) | DAOPARP1DDOPADI4XDH | |
| SCHEMBL24566409 | 0.76 | DYRK1A (0.47) | ALDH1A1 | |
| SCHEMBL15785416 | 0.76 | PARP1 (0.37) | PARP1PADI4 | |
| SCHEMBL14820336 | 0.72 | KDM4E (0.33) | ALDH1A1GAA | |
| SCHEMBL14805792 | 0.68 | KDM4E (0.37) | DAO | |
| SCHEMBL669933 | 0.68 | AXL (0.42) | PARP1ALDH1A1 | |
| SCHEMBL29547282 | 0.67 | ADORA2A (0.34) | XDHALDH1A1 | |
| SCHEMBL4219276 | 0.67 | ADORA2A (0.34) | XDHALDH1A1 | |
| SCHEMBL11202110 | 0.66 | AXL (0.51) | ALDH1A1GAA |
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-117946096-A | Vitamin Li Xigu intermediate and preparation method thereof | 上海医药工业研究院有限公司 | 2024-04-30 | — | — | CN | disclosed |
| CN-117946097-A | Vitamin Li Xigu, intermediate thereof and preparation method | 上海医药工业研究院有限公司 | 2024-04-30 | — | — | CN | disclosed |