Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.67 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.67 |
| ▸ | MYC | P01106 | 1/20 | 0.42 |
| ▸ | PDK2 | Q15119 | 9/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27497315 | 0.82 | THRB (0.71) | THRBTDP1PDK2APEX1ALDH1A1 | |
| Methyl Alcohol SCHEMBL21134117 | 0.81 | THRB (0.91) | THRBTDP1PDK2APEX1ALDH1A1 | |
| SCHEMBL66735 | 0.81 | THRB (1.00) | THRBTDP1PDK2APEX1CA1 | |
| SCHEMBL30488775 | 0.81 | THRB (1.00) | THRBTDP1PDK2APEX1CA1 | |
| SCHEMBL11469925 | 0.81 | THRB (1.00) | THRBTDP1PDK2APEX1CA1 | |
| SCHEMBL11104434 | 0.80 | THRB (0.57) | THRBTDP1PDK2APEX1ALDH1A1 | |
| Bromomethane SCHEMBL208217 | 0.80 | THRB (0.88) | THRBTDP1PDK2APEX1ALDH1A1 | |
| SCHEMBL6781995 | 0.79 | THRB (0.47) | THRBTDP1MYCPDK2ESR1 | |
| Bromide SCHEMBL27743796 | 0.79 | THRB (0.95) | THRBTDP1PDK2APEX1CA1 | |
| Dimethylamine SCHEMBL10338435 | 0.78 | THRB (0.84) | THRBTDP1PDK2APEX1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6160194-A | Soil decontamination using ferric chelates and peroxide | THE CONNECTICUT AGRICULTURAL EXPERIMENT STATION (US) | 2000-12-12 | — | — | US | disclosed |
| US-5232484-A | Aqueous acid solution; mineralization; absence of large concentrations of organic solvents, chloride and sulfate | THE CONNECTICUT AGRICULTURAL EXPERIMENT STATION (US) | 1993-08-03 | — | — | US | disclosed |
| US-3960540-A | 2-CHLOROETHYLPHOSPHONIC ACID AND 3-TRICHLOROMETHYLSULFONAMIDO-P-ACETOTOLUIDIDE | GENERAL FOODS CORPORATION (US) | 1976-06-01 | — | — | US | disclosed |