Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27819759 | 0.75 | TP53 (0.42) | MAPK1AHRHPGDTSHRHSD17B10 | |
| SCHEMBL14720007 | 0.72 | — | — | |
| SCHEMBL22683937 | 0.72 | HSD17B10 (0.46) | HPGDHSD17B10 | |
| SCHEMBL30808858 | 0.72 | RAB9A (0.33) | MAPK1HPGD | |
| SCHEMBL27813956 | 0.72 | KDM4E (0.33) | HPGD | |
| SCHEMBL15733288 | 0.68 | HTR3E (0.45) | HPGDTSHR | |
| SCHEMBL29365405 | 0.68 | HTR3E (0.45) | HPGDTSHR | |
| SCHEMBL17260091 | 0.68 | HSP90AA1 (0.36) | MAPK1HPGDHSD17B10 | |
| SCHEMBL21594218 | 0.68 | MEN1 (0.36) | MAPK1HPGDHSD17B10 | |
| SCHEMBL21489666 | 0.68 | PDE2A (0.38) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113773356-B | Picroside II derivative and preparation method and application thereof | 河南中医药大学 | 2024-02-02 | — | — | CN | claimed |
| CN-113773356-A | Picroside II derivative and preparation method and application thereof | 河南中医药大学 | 2021-12-10 | — | — | CN | claimed |
| CN-113773356-B | Picroside II derivative and preparation method and application thereof | 河南中医药大学 | 2024-02-02 | — | — | CN | disclosed |
| CN-113773356-A | Picroside II derivative and preparation method and application thereof | 河南中医药大学 | 2021-12-10 | — | — | CN | disclosed |