Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 17/20 | 0.72 |
| ▸ | ESR2 | Q92731 | 17/20 | 0.72 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.47 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3928809 | 0.84 | ESR1 (1.00) | ESR1ESR2HSD17B1HSD17B2CYP1A2 | |
| SCHEMBL16982203 | 0.81 | ESR1 (0.74) | ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL3925203 | 0.81 | ESR1 (1.00) | ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL16982202 | 0.81 | ESR1 (0.74) | ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL16982206 | 0.78 | ESR1 (0.71) | ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL3924515 | 0.77 | ESR2 (1.00) | ESR1ESR2HSD17B1HSD17B2CYP1A2 | |
| SCHEMBL5514174 | 0.76 | ESR1 (0.72) | ESR1ESR2HSD17B1HSD17B2CYP1A2 | |
| SCHEMBL16982137 | 0.76 | ESR1 (0.60) | ESR1ESR2HSD17B1HSD17B2CYP3A4 | |
| SCHEMBL16982205 | 0.76 | ESR1 (0.67) | ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL16982200 | 0.75 | ESR1 (0.73) | ESR1ESR2HSD17B1HSD17B2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015115589-A1 | HALOGEN ATOM-SUBSTITUTED POLYMERIZABLE COMPOUND | 日産化学工業株式会社 | 2015-08-06 | — | — | WO | disclosed |