Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | RARB | P10826 | 6/20 | 0.54 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.54 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.53 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Heptane SCHEMBL27762248 | 1.00 | TP53 (0.54) | TP53TSHRRARBPTPN11PLA2G4B | |
| Heptane SCHEMBL28843668 | 0.97 | TP53 (0.51) | TP53TSHRRARBPTPN11PLA2G4B | |
| Pentane SCHEMBL27676126 | 0.95 | RARB (0.48) | TP53TSHRRARBPTPN11PLA2G4B | |
| 1-Hexanol SCHEMBL27325202 | 0.94 | RARB (0.52) | TP53TSHRRARBPTPN11PLA2G4B | |
| Decanoic Acid SCHEMBL28022829 | 0.92 | GPR84 (0.50) | TP53TSHRRARBPTPN11 | |
| Octanoic Acid SCHEMBL28183679 | 0.92 | GPR84 (0.50) | TP53TSHRRARBPTPN11 | |
| Butane SCHEMBL27422579 | 0.91 | TSHR (0.47) | TP53TSHRRARBPTPN11 | |
| Hexanoate SCHEMBL27657416 | 0.91 | AKR1B1 (0.48) | TP53TSHRRARBPTPN11 | |
| SCHEMBL27499082 | 0.90 | RARB (0.46) | TP53TSHRRARBPTPN11PLA2G4B | |
| Valeric Acid SCHEMBL28183585 | 0.89 | MEN1 (0.44) | TP53TSHRRARBPTPN11PLA2G4B |
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-102781421-B | Extrait du fruit de schizandra sphenanthera et compositions cosmetiques, dermatologiques et nutraceutiques le comprenant | EXPANSCIENCE LAB | 2015-07-01 | — | — | CN | disclosed |