Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSIP1 | O75475 | 2/20 | 0.78 |
| ▸ | HSD11B1 | P28845 | 5/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | CA3 | P07451 | 1/20 | 0.48 |
| ▸ | CA4 | P22748 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | ESR1 | P03372 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | BCAT1 | P54687 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL180713 | 0.89 | PSIP1 (1.00) | PSIP1HSD11B1POLBCA12CA1 | |
| Sulfuric Acid SCHEMBL27681094 | 0.86 | PSIP1 (0.86) | PSIP1HSD11B1POLBALDH1A1TP53 | |
| Ammonia Solution, Strong SCHEMBL6978426 | 0.86 | PSIP1 (0.95) | PSIP1HSD11B1POLBCA12CA1 | |
| Fluoride SCHEMBL9493182 | 0.86 | PSIP1 (0.95) | PSIP1HSD11B1POLBCA12CA1 | |
| SCHEMBL789569 | 0.84 | PSIP1 (0.82) | PSIP1HSD11B1POLBALDH1A1TP53 | |
| Acetic Acid SCHEMBL28112958 | 0.84 | PSIP1 (0.82) | PSIP1HSD11B1POLBALDH1A1TP53 | |
| SCHEMBL1657371 | 0.84 | CA2 (0.59) | PSIP1CA12CA1CA2CA9 | |
| Methylamine SCHEMBL28266275 | 0.84 | PSIP1 (0.90) | PSIP1HSD11B1POLBCA12CA1 | |
| SCHEMBL27891797 | 0.82 | PSIP1 (0.86) | PSIP1HSD11B1POLBCA12CA1 | |
| SCHEMBL2642996 | 0.81 | PSIP1 (0.56) | PSIP1CA12CA2CA9CA14 |
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-109563103-A | modulators of beta-3 adrenergic receptors for the treatment or prevention of disorders related thereto | 艾尼纳制药公司 | 2019-04-02 | — | — | CN | disclosed |