Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 9/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | HSD17B3 | P37058 | 7/20 | 0.37 |
| ▸ | PLK1 | P53350 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.35 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL28730305 | 0.82 | ESR1 (0.58) | ESR1ESR2ALDH1A1CYP3A4HSD17B3 | |
| SCHEMBL6544810 | 0.80 | ESR1 (0.56) | ESR1ESR2ALDH1A1CYP3A4HSD17B3 | |
| SCHEMBL10435794 | 0.80 | ESR1 (0.56) | ESR1ESR2ALDH1A1CYP3A4HSD17B3 | |
| SCHEMBL27477026 | 0.78 | ESR1 (0.53) | ESR1ESR2ALDH1A1CYP3A4HSD17B3 | |
| SCHEMBL8502147 | 0.77 | KDM4E (0.38) | ALDH1A1LMNACYP1A2CYP2D6MAPK1 | |
| SCHEMBL5699266 | 0.76 | ESR1 (0.50) | ESR1ESR2ALDH1A1CYP3A4HSD17B3 | |
| SCHEMBL5699297 | 0.76 | ESR1 (0.50) | ESR1ESR2ALDH1A1CYP3A4HSD17B3 | |
| SCHEMBL3914141 | 0.75 | ESR1 (0.50) | ESR1ESR2ALDH1A1CYP3A4SMN1; SMN2 | |
| SCHEMBL28583888 | 0.74 | ESR1 (0.46) | ESR1ESR2ALDH1A1CYP1A2TSHR | |
| SCHEMBL51337 | 0.73 | ESR1 (0.59) | ESR1ESR2ALDH1A1CYP3A4HSD17B3 |
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 |
|---|---|---|---|---|---|---|---|
| US-4311637-A | Polyphenolic esters of mercaptophenols as antioxidants | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1982-01-19 | — | — | US | claimed |