Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | ESRRG | P62508 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10629932 | 0.68 | ESR1 (0.41) | ESR1ESR2HPGDTSHRCYP3A4 | |
| SCHEMBL637047 | 0.68 | ESR1 (0.41) | ESR1ESR2HPGDTSHRCYP3A4 | |
| SCHEMBL17923896 | 0.63 | TSHR (0.61) | ESR1ESR2HPGDTSHRCYP3A4 | |
| SCHEMBL635624 | 0.61 | ALDH1A1 (0.31) | TSHRALDH1A1 | |
| SCHEMBL4942966 | 0.61 | TSHR (0.67) | ESR1ESR2HPGDTSHRCYP3A4 | |
| SCHEMBL7535051 | 0.61 | ESR1 (0.75) | ESR1ESR2HPGDTSHRCYP3A4 | |
| SCHEMBL18901114 | 0.61 | TSHR (0.67) | ESR1ESR2HPGDTSHRCYP3A4 | |
| SCHEMBL22931017 | 0.59 | PDE2A (0.48) | ESR1ESR2HPGDTSHRCYP3A4 | |
| SCHEMBL13141988 | 0.59 | ESR1 (0.52) | ESR1ESR2HPGDTSHRCYP3A4 | |
| SCHEMBL5961662 | 0.59 | ESR1 (0.52) | ESR1ESR2HPGDTSHRCYP3A4 |
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-20040122201-A1 | polysulfides; improved impact resistance | MITSUBISHI GAS CHEMICAL COMPANY (JP) | 2004-06-24 | — | — | US | disclosed |