Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.49 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | ABCG2 | Q9UNQ0 | 5/20 | 0.47 |
| ▸ | ESR1 | P03372 | 2/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.47 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.47 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.47 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | PDE5A | O76074 | 1/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.44 |
| ▸ | SOAT2 | O75908 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7052282 | 0.81 | PTPN1 (0.68) | ACHEPTPN1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL31237386 | 0.81 | PTPN1 (0.68) | ACHEPTPN1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL27013508 | 0.80 | ACHE (0.67) | ACHEPTPN1CYP3A4CYP2D6CYP2C9 | |
| Neophellamuretin SCHEMBL30766255 | 0.79 | ABCG2 (0.66) | ACHEPTPN1CYP3A4CYP2D6CYP2C9 | |
| Neophellamuretin SCHEMBL27013455 | 0.79 | ABCG2 (0.66) | ACHEPTPN1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL1170819 | 0.70 | PTPN1 (0.77) | ACHEPTPN1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL1170822 | 0.70 | PTPN1 (0.77) | ACHEPTPN1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL27013484 | 0.70 | PTPN1 (0.80) | ACHEPTPN1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL30819254 | 0.69 | PTPN1 (0.66) | PTPN1CYP19A1CYP1A1CYP1B1GAA | |
| SCHEMBL27013475 | 0.69 | ESR1 (0.68) | ACHECYP3A4CYP2D6CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220183271-A1 | Methods and Systems for Protective Supplementation During Temperature Depression | MEMBRANE PROTECTIVE TECHNOLOGIES, INC. | 2022-06-16 | — | — | US | claimed |
| CN-114394884-B | Preparation method of allylphenol compound | 暨南大学 | 2023-06-16 | — | — | CN | disclosed |
| US-20220183271-A1 | Methods and Systems for Protective Supplementation During Temperature Depression | MEMBRANE PROTECTIVE TECHNOLOGIES, INC. | 2022-06-16 | — | — | US | disclosed |
| CN-114394884-A | Preparation method of allyl phenol compound | 暨南大学 | 2022-04-26 | — | — | CN | disclosed |