Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.70 |
| ▸ | APAF1 | O14727 | 1/20 | 0.70 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.64 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.64 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.64 |
| ▸ | MAOA | P21397 | 1/20 | 0.57 |
| ▸ | MAOB | P27338 | 1/20 | 0.57 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.54 |
| ▸ | SOAT1 | P35610 | 10/20 | 0.54 |
| ▸ | S100A4 | P26447 | 2/20 | 0.53 |
| ▸ | MALT1 | Q9UDY8 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL21814430 | 1.00 | ALDH1A1 (0.70) | ALDH1A1APAF1CYP1A2CYP2C8CYP2C9 | |
| SCHEMBL21814542 | 1.00 | ALDH1A1 (0.70) | ALDH1A1APAF1CYP1A2CYP2C8CYP2C9 | |
| SCHEMBL21814429 | 1.00 | ALDH1A1 (0.70) | ALDH1A1APAF1CYP1A2CYP2C8CYP2C9 | |
| SCHEMBL21814493 | 1.00 | ALDH1A1 (0.70) | ALDH1A1APAF1CYP1A2CYP2C8CYP2C9 | |
| SCHEMBL21814443 | 1.00 | ALDH1A1 (0.70) | ALDH1A1APAF1CYP1A2CYP2C8CYP2C9 | |
| SCHEMBL21814487 | 1.00 | ALDH1A1 (0.70) | ALDH1A1APAF1CYP1A2CYP2C8CYP2C9 | |
| SCHEMBL21814433 | 1.00 | ALDH1A1 (0.70) | ALDH1A1APAF1CYP1A2CYP2C8CYP2C9 | |
| SCHEMBL21814576 | 1.00 | ALDH1A1 (0.70) | ALDH1A1APAF1CYP1A2CYP2C8CYP2C9 | |
| SCHEMBL21814535 | 1.00 | ALDH1A1 (0.70) | ALDH1A1APAF1CYP1A2CYP2C8CYP2C9 | |
| SCHEMBL21814439 | 1.00 | ALDH1A1 (0.70) | ALDH1A1APAF1CYP1A2CYP2C8CYP2C9 |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11312793-B2 | Amino-quinone antipolymerants and methods of using | ECOLAB USA INC. (US) | 2022-04-26 | — | — | US | claimed |
| EP-3856792-A1 | AMINO-QUINONE ANTIPOLYMERANTS AND METHODS OF USING | Ecolab USA, Inc. (US) | 2021-08-04 | — | — | EP | claimed |
| 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 |
| WO-2020068735-A1 | AMINO-QUINONE ANTIPOLYMERANTS AND METHODS OF USING | ECOLAB USA INC. (US) | 2020-04-02 | — | — | WO | claimed |
| US-20200102408-A1 | AMINO-QUINONE ANTIPOLYMERANTS AND METHODS OF USING | ECOLAB USA INC. | 2020-04-02 | — | — | US | claimed |
| 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 |
| 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 |
| WO-2020068735-A1 | AMINO-QUINONE ANTIPOLYMERANTS AND METHODS OF USING | ECOLAB USA INC. (US) | 2020-04-02 | — | — | WO | disclosed |
| US-20200102408-A1 | AMINO-QUINONE ANTIPOLYMERANTS AND METHODS OF USING | ECOLAB USA INC. | 2020-04-02 | — | — | US | disclosed |