Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 16/20 | 0.73 |
| ▸ | HSD17B2 | P37059 | 16/20 | 0.73 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.73 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.73 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.73 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.73 |
| ▸ | CYP2B6 | P20813 | 4/20 | 0.73 |
| ▸ | ESR1 | P03372 | 2/20 | 0.53 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.51 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.48 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL4426843 | 0.87 | HSD17B1 (0.57) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3012675 | 0.84 | HSD17B1 (1.00) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5005580 | 0.83 | HSD17B1 (0.59) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL619730 | 0.83 | ESR1 (0.61) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL22795574 | 0.81 | ALOX5 (0.60) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3008799 | 0.81 | HSD17B1 (1.00) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| Ammonia Solution, Strong SCHEMBL10871253 | 0.81 | ESR1 (0.59) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL23259335 | 0.81 | HSD17B1 (0.51) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL31545504 | 0.80 | HSD17B1 (0.61) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL22639434 | 0.80 | HSD17B1 (0.50) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 |
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-119569549-A | 2-Phenyl naphthalene derivative and application thereof in preparation of anti-liver cancer drugs | 浙江大学 | 2025-03-07 | — | — | CN | disclosed |