Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | CA2 | P00918 | 5/20 | 0.52 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.45 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | ATP2A2 | P16615 | 1/20 | 0.39 |
| ▸ | ATP2A3 | Q93084 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | TYR | P14679 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4594554 | 0.88 | ALDH1A1 (0.56) | ALDH1A1TDP1TSHRCA2GABRA1 | |
| SCHEMBL27809376 | 0.87 | CA2 (0.52) | ALDH1A1TDP1TSHRCA2GABRA1 | |
| SCHEMBL20115058 | 0.82 | P2RX7 (0.41) | ALDH1A1TDP1TSHRCA2GABRA1 | |
| SCHEMBL11428350 | 0.81 | ALDH1A1 (0.39) | ALDH1A1TDP1TSHRCA2GABRA1 | |
| SCHEMBL8888131 | 0.81 | ALDH1A1 (0.43) | ALDH1A1TDP1TSHRCA2GABRA1 | |
| SCHEMBL11162580 | 0.80 | ALDH1A1 (0.52) | ALDH1A1TDP1TSHRCA2GABRA1 | |
| SCHEMBL725385 | 0.79 | GABRA1 (0.52) | ALDH1A1TDP1TSHRCA2GABRA1 | |
| SCHEMBL30419675 | 0.77 | GABRA1 (0.43) | ALDH1A1TDP1TSHRCA2GABRA1 | |
| SCHEMBL16884652 | 0.77 | CA2 (0.43) | ALDH1A1TDP1TSHRCA2GABRA1 | |
| SCHEMBL4596045 | 0.76 | CYP2C9 (0.47) | ALDH1A1TDP1TSHRCA2GABRA1 |
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-108484365-B | Method for separating m-isopropylphenol and p-isopropylphenol | 陕西巴斯腾科技有限公司 | 2023-02-28 | — | — | CN | disclosed |