Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 3/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21819284 | 0.91 | ACHE (0.40) | ACHEBACE1TDP1MAPTMAPK1 | |
| SCHEMBL21814514 | 0.86 | HCAR3 (0.35) | TDP1CYP3A4MAPTMAPK1TSHR | |
| SCHEMBL28570427 | 0.84 | ACHE (0.46) | ELANEACHEBACE1TDP1AR | |
| SCHEMBL28553031 | 0.77 | ACHE (0.51) | ACHEBACE1TDP1MAPTMAPK1 | |
| SCHEMBL21814508 | 0.75 | ALDH1A1 (0.34) | TDP1CYP3A4MAPTMAPK1HTT | |
| SCHEMBL9654649 | 0.74 | ALOX5 (0.31) | ACHEBACE1TDP1MAPTMAPK1 | |
| SCHEMBL15672209 | 0.74 | ELANE (0.41) | ELANETDP1ARHTTNCOA1 | |
| SCHEMBL28549550 | 0.70 | ACHE (0.40) | ACHEBACE1TDP1MAPTMEN1 | |
| SCHEMBL6129243 | 0.67 | ELANE (0.31) | ELANE | |
| SCHEMBL28247119 | 0.66 | ACHE (0.44) | ACHEBACE1TDP1MAPTMEN1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112739725-B | Amino quinone anti-polymerization agent and method of use thereof | 埃科莱布美国股份有限公司 | 2023-09-26 | — | — | CN | disclosed |
| US-11312793-B2 | Amino-quinone antipolymerants and methods of using | ECOLAB USA INC. (US) | 2022-04-26 | — | — | US | disclosed |
| EP-3856792-A1 | AMINO-QUINONE ANTIPOLYMERANTS AND METHODS OF USING | Ecolab USA, Inc. (US) | 2021-08-04 | — | — | EP | disclosed |
| US-20200102408-A1 | AMINO-QUINONE ANTIPOLYMERANTS AND METHODS OF USING | ECOLAB USA INC. | 2020-04-02 | — | — | US | disclosed |
| WO-2020068735-A1 | AMINO-QUINONE ANTIPOLYMERANTS AND METHODS OF USING | ECOLAB USA INC. (US) | 2020-04-02 | — | — | WO | disclosed |
| US-4090970-A | (2,2'-THIOBIS-(4-TERT-OCTYLPHENOLATO))-N-BUTYLAMINE NICKEL | MOBIL OIL CORPORATION (US) | 1978-05-23 | — | — | US | disclosed |