Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 1/20 | 0.47 |
| ▸ | ADH1C | P00326 | 1/20 | 0.47 |
| ▸ | ADH1A | P07327 | 1/20 | 0.47 |
| ▸ | ANPEP | P15144 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | MMP1 | P03956 | 1/20 | 0.32 |
| ▸ | MMP8 | P22894 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL64203 | 0.96 | — | — | |
| Lithium SCHEMBL30576662 | 0.92 | ADH1B (0.47) | ADH1BADH1CADH1AANPEPCYP2C19 | |
| Hydrochloric Acid SCHEMBL1062697 | 0.92 | ADH1B (0.47) | ADH1BADH1CADH1AANPEPCYP2C19 | |
| SCHEMBL27812939 | 0.92 | ADH1B (0.47) | ADH1BADH1CADH1AANPEPCYP2C19 | |
| SCHEMBL399646 | 0.92 | — | — | |
| Water SCHEMBL11344239 | 0.92 | ADH1B (0.47) | ADH1BADH1CADH1AANPEPCYP2C19 | |
| Methane SCHEMBL9112529 | 0.92 | ADH1B (0.47) | ADH1BADH1CADH1AANPEPCYP2C19 | |
| Ammonia Solution, Strong SCHEMBL12490708 | 0.92 | ADH1B (0.47) | ADH1BADH1CADH1AANPEPCYP2C19 | |
| Fluoride SCHEMBL1055864 | 0.92 | ADH1B (0.47) | ADH1BADH1CADH1AANPEPCYP2C19 | |
| SCHEMBL27352567 | 0.92 | ADH1B (0.47) | ADH1BADH1CADH1AANPEPCYP2C19 |
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-117069720-A | 5-HT 2A Receptor agonist, preparation method and application thereof | 上海翊石医药科技有限公司 | 2023-11-17 | — | — | CN | disclosed |