Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.64 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.56 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.56 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.56 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.48 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.44 |
| ▸ | FAAH | O00519 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.44 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Benzyl Alcohol SCHEMBL4915528 | 0.83 | TSHR (0.74) | TSHRTRPA1SLC6A2LTA4HPPARA | |
| Hydrogen Peroxide SCHEMBL29394264 | 0.83 | GABRA1 (0.65) | TSHRGABRA1GABRG2GABRB3GABRB2 | |
| Hydrogen Peroxide SCHEMBL30120583 | 0.83 | GABRA1 (0.65) | TSHRGABRA1GABRG2GABRB3GABRB2 | |
| Hydrogen Peroxide SCHEMBL35519 | 0.83 | GABRA1 (0.65) | TSHRGABRA1GABRG2GABRB3GABRB2 | |
| Hydrogen Peroxide SCHEMBL20593356 | 0.83 | GABRA1 (0.65) | TSHRGABRA1GABRG2GABRB3GABRB2 | |
| Hydrogen Peroxide SCHEMBL99126 | 0.83 | GABRA1 (0.65) | TSHRGABRA1GABRG2GABRB3GABRB2 | |
| Benzyl Alcohol SCHEMBL28599336 | 0.82 | TSHR (0.64) | TSHRTRPA1SLC6A2LTA4HTAAR1 | |
| Benzyl Alcohol SCHEMBL3949110 | 0.81 | TSHR (0.70) | TSHRTRPA1SLC6A2CYP3A4LTA4H | |
| Methyl Alcohol SCHEMBL9506418 | 0.80 | GABRA1 (0.62) | TSHRGABRA1GABRG2GABRB3GABRB2 | |
| Hydrogen Peroxide SCHEMBL28105643 | 0.80 | GABRA1 (0.62) | TSHRGABRA1GABRG2GABRB3GABRB2 |
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-113173874-B | Method for extracting hydroperoxide from m-diisopropylbenzene oxidation product | 北京工业大学 | 2022-12-13 | — | — | CN | disclosed |
| CN-113135819-B | Method for improving yield of resorcinol prepared by m-diisopropylbenzene oxidation | 北京工业大学 | 2022-07-15 | — | — | CN | disclosed |
| CN-113173874-A | Method for extracting hydroperoxide from m-diisopropylbenzene oxidation product | 北京工业大学 | 2021-07-27 | — | — | CN | disclosed |
| CN-113135819-A | Method for improving yield of resorcinol prepared by m-diisopropylbenzene oxidation | 北京工业大学 | 2021-07-20 | — | — | CN | disclosed |