Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 2/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.38 |
| ▸ | DHFR | P00374 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28051089 | 0.83 | ALDH1A1 (0.53) | ALDH1A1TSHRPOLBMEN1KMT2A | |
| SCHEMBL28388106 | 0.82 | NR3C1 (0.41) | NR3C1GABRA1GABRB2ALDH1A1TSHR | |
| Ammonia Solution, Strong SCHEMBL28051013 | 0.81 | ALDH1A1 (0.51) | ALDH1A1TSHRPOLBMEN1KMT2A | |
| SCHEMBL28050932 | 0.81 | ALDH1A1 (0.51) | ALDH1A1TSHRPOLBMEN1KMT2A | |
| Sulfuric Acid SCHEMBL20985018 | 0.81 | ALDH1A1 (0.46) | GABRA1GABRB2ALDH1A1POLBCLCN2 | |
| SCHEMBL12470061 | 0.79 | MAPT (0.43) | NR3C1ALDH1A1POLBMEN1KMT2A | |
| SCHEMBL29196078 | 0.77 | DHFR (0.50) | GABRA1GABRB2ALDH1A1CLCN2DHFR | |
| SCHEMBL5436495 | 0.75 | KCNH2 (0.46) | GABRA1GABRB2ALDH1A1POLBCLCN2 | |
| SCHEMBL15093896 | 0.74 | HTT (0.53) | GABRA1GABRB2ALDH1A1POLBCLCN2 | |
| SCHEMBL2018495 | 0.74 | CLCN2 (0.47) | GABRA1GABRB2ALDH1A1TSHRPOLB |
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-108779356-B | Printing ink | 富士胶片株式会社 | 2021-07-02 | — | — | CN | disclosed |