Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 4/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.38 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL12781853 | 0.83 | CYP3A4 (0.54) | ALDH1A1CYP3A4SMN1; SMN2ACHEMEN1 | |
| SCHEMBL4713032 | 0.80 | CYP3A4 (0.51) | ALDH1A1CYP3A4SMN1; SMN2ACHEMEN1 | |
| SCHEMBL3670353 | 0.75 | ALDH1A1 (0.47) | ALDH1A1CYP3A4SMN1; SMN2ACHEMEN1 | |
| SCHEMBL6968876 | 0.75 | CYP3A4 (0.47) | ALDH1A1CYP3A4SMN1; SMN2ACHEHSD17B10 | |
| SCHEMBL523983 | 0.75 | ALDH1A1 (0.53) | ALDH1A1CYP3A4SMN1; SMN2ACHEHSD17B10 | |
| SCHEMBL31405856 | 0.74 | CYP3A4 (0.46) | ALDH1A1CYP3A4SMN1; SMN2ACHEHSD17B10 | |
| SCHEMBL28499811 | 0.72 | CYP3A4 (0.50) | ALDH1A1CYP3A4SMN1; SMN2ACHEMEN1 | |
| SCHEMBL7270880 | 0.72 | ACHE (0.45) | CYP3A4ACHEMAPTTUBB4ATUBB | |
| SCHEMBL1465391 | 0.72 | CYP3A4 (0.64) | ALDH1A1CYP3A4SMN1; SMN2ACHEHSD17B10 | |
| SCHEMBL6582676 | 0.71 | CYP3A4 (0.46) | ALDH1A1CYP3A4SMN1; SMN2ACHEHSD17B10 |
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-119798207-A | Preparation method of 3-methoxy-4, 5-methylenedioxy phenethylamine | 常州瑞明药业股份有限公司 | 2025-04-11 | — | — | CN | disclosed |