Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 2/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | PPARA | Q07869 | 2/20 | 0.42 |
| ▸ | FAAH | O00519 | 3/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | APAF1 | O14727 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21818861 | 0.91 | ACHE (0.51) | ACHEBACE1APAF1ALDH1A1 | |
| SCHEMBL21814435 | 0.91 | ACHE (0.51) | ACHEBACE1APAF1ALDH1A1 | |
| SCHEMBL21814513 | 0.91 | ACHE (0.51) | ACHEBACE1APAF1ALDH1A1 | |
| SCHEMBL21814590 | 0.91 | ACHE (0.51) | ACHEBACE1APAF1ALDH1A1 | |
| SCHEMBL21814453 | 0.91 | ACHE (0.51) | ACHEBACE1APAF1ALDH1A1 | |
| SCHEMBL21814610 | 0.91 | ACHE (0.51) | ACHEBACE1APAF1ALDH1A1 | |
| SCHEMBL21814469 | 0.91 | ACHE (0.51) | ACHEBACE1APAF1ALDH1A1 | |
| SCHEMBL21814442 | 0.91 | ACHE (0.51) | ACHEBACE1APAF1ALDH1A1 | |
| SCHEMBL21814422 | 0.91 | ACHE (0.51) | ACHEBACE1APAF1ALDH1A1 | |
| SCHEMBL21814492 | 0.91 | ACHE (0.51) | ACHEBACE1APAF1ALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112739725-A | Amino quinone anti-polymerization agents and methods of use thereof | 埃科莱布美国股份有限公司 | 2021-04-30 | — | — | CN | claimed |
| US-20200102408-A1 | AMINO-QUINONE ANTIPOLYMERANTS AND METHODS OF USING | ECOLAB USA INC. | 2020-04-02 | — | — | US | claimed |
| US-11312793-B2 | Amino-quinone antipolymerants and methods of using | ECOLAB USA INC. (US) | 2022-04-26 | — | — | US | disclosed |
| CN-112739725-A | Amino quinone anti-polymerization agents and methods of use thereof | 埃科莱布美国股份有限公司 | 2021-04-30 | — | — | CN | disclosed |
| US-20200102408-A1 | AMINO-QUINONE ANTIPOLYMERANTS AND METHODS OF USING | ECOLAB USA INC. | 2020-04-02 | — | — | US | disclosed |