Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.48 |
| ▸ | CYP17A1 | P05093 | 7/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 6/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 6/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.39 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 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 | |
|---|---|---|---|---|
| SCHEMBL9609757 | 0.91 | TSHR (0.56) | ALDH1A1TSHRTRPA1HRH3ESR1 | |
| SCHEMBL679626 | 0.91 | TSHR (0.56) | ALDH1A1TSHRTRPA1HRH3ESR1 | |
| SCHEMBL5885289 | 0.91 | ALDH1A1 (0.56) | ALDH1A1TSHRTRPA1CYP3A4TDP1 | |
| Methane SCHEMBL11480910 | 0.88 | TSHR (0.53) | ALDH1A1TSHRTRPA1HRH3ESR1 | |
| Water SCHEMBL11481683 | 0.88 | TSHR (0.53) | ALDH1A1TSHRTRPA1HRH3ESR1 | |
| SCHEMBL10049247 | 0.82 | TRPA1 (0.48) | ALDH1A1TSHRTRPA1CYP17A1CYP11B1 | |
| SCHEMBL131361 | 0.80 | ALDH1A1 (0.67) | ALDH1A1TSHRTRPA1CYP3A4HRH3 | |
| SCHEMBL712948 | 0.80 | TRPA1 (0.78) | ALDH1A1TSHRTRPA1TDP1CA12 | |
| SCHEMBL1374017 | 0.80 | ALDH1A1 (0.68) | ALDH1A1TSHRTRPA1CYP3A4TDP1 | |
| SCHEMBL3362246 | 0.80 | ALDH1A1 (0.50) | ALDH1A1TSHRTRPA1HRH3CA12 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119462762-A | Chiral ring papain BinapoBox.4PF6Preparation method and application thereof | 黑龙江大学 | 2025-02-18 | — | — | CN | claimed |
| CN-119462762-A | Chiral ring papain BinapoBox.4PF6Preparation method and application thereof | 黑龙江大学 | 2025-02-18 | — | — | CN | disclosed |