Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 3/20 | 0.50 |
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.46 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TYR | P14679 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | HPN | P05981 | 1/20 | 0.39 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.39 |
| ▸ | NR5A2 | O00482 | 1/20 | 0.39 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7648280 | 1.00 | HSP90AA1 (0.56) | HSP90AA1CA2CA1GABRA1GABRB2 | |
| SCHEMBL18763612 | 0.92 | CA2 (0.61) | HSP90AA1CA2CA1GABRA1GABRB2 | |
| SCHEMBL29370116 | 0.87 | HSP90AA1 (0.62) | HSP90AA1CA2CA1GABRA1GABRB2 | |
| SCHEMBL29671062 | 0.87 | HSP90AA1 (0.62) | HSP90AA1CA2CA1GABRA1GABRB2 | |
| SCHEMBL241470 | 0.87 | HSP90AA1 (0.62) | HSP90AA1CA2CA1GABRA1GABRB2 | |
| SCHEMBL8060062 | 0.83 | CA2 (0.45) | HSP90AA1CA2CA1GABRA1GABRB2 | |
| SCHEMBL6320034 | 0.83 | CYP1A2 (0.53) | HSP90AA1CA2CA1CYP1A2CYP2C9 | |
| SCHEMBL3818856 | 0.81 | CYP2C9 (0.47) | HSP90AA1CA2CA1GABRA1GABRB2 | |
| SCHEMBL8489425 | 0.81 | CA2 (0.77) | CA2CA1GABRA1GABRB2CYP1A2 | |
| SCHEMBL14820672 | 0.80 | CYP1A2 (0.50) | HSP90AA1CA2CA1CYP1A2CYP2C9 |
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-115109093-A | Phosphonite-phosphite based ligands | 赢创运营有限公司 | 2022-09-27 | — | — | CN | disclosed |