Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 7/20 | 0.64 |
| ▸ | XDH | P47989 | 1/20 | 0.51 |
| ▸ | LDHA | P00338 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.45 |
| ▸ | PRKCA | P17252 | 3/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | MMP3 | P08254 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | MMP12 | P39900 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.44 |
| ▸ | SNCA | P37840 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | AMY2A | P04746 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29425973 | 0.88 | HSP90AA1 (0.74) | HSP90AA1XDHLDHAPRKCACYP19A1 | |
| SCHEMBL29642990 | 0.87 | HSP90AA1 (0.85) | HSP90AA1XDHLDHAEPHX2PRKCA | |
| Picroside I SCHEMBL14361938 | 0.86 | HSP90AA1 (0.64) | HSP90AA1XDHLDHAEPHX2PRKCA | |
| Picroside I SCHEMBL29362839 | 0.86 | HSP90AA1 (0.64) | HSP90AA1XDHLDHAEPHX2PRKCA | |
| SCHEMBL29426078 | 0.84 | HSP90AA1 (0.49) | HSP90AA1LDHAEPHX2PRKCACYP19A1 | |
| SCHEMBL423457 | 0.83 | HSP90AA1 (0.74) | HSP90AA1XDHLDHAPRKCASNCA | |
| Minecoside SCHEMBL29426074 | 0.81 | HSP90AA1 (0.85) | HSP90AA1XDHLDHAEPHX2PRKCA | |
| SCHEMBL422039 | 0.80 | HSP90AA1 (0.71) | HSP90AA1XDHLDHAPRKCASNCA | |
| SCHEMBL29425942 | 0.80 | HSP90AA1 (0.62) | HSP90AA1XDHPRKCACYP19A1MMP2 | |
| Verminoside SCHEMBL29425838 | 0.78 | HSP90AA1 (1.00) | HSP90AA1XDHPRKCACYP19A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116549472-A | Application of Picroside III in preparation of medicines for preventing and/or treating inflammatory bowel disease | 北京大学深圳医院（北京大学深圳临床医学院） | 2023-08-08 | — | — | CN | disclosed |