Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | CRHBP | P24387 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.46 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30959 | 0.89 | ALDH1A1 (0.67) | ALDH1A1TDP1L3MBTL1CYP3A4CYP2C9 | |
| Benzene SCHEMBL28083527 | 0.89 | ALDH1A1 (0.67) | ALDH1A1TDP1L3MBTL1CYP3A4CYP2C9 | |
| SCHEMBL9490577 | 0.89 | ALDH1A1 (0.67) | ALDH1A1TDP1L3MBTL1CYP3A4CYP2C9 | |
| SCHEMBL453160 | 0.89 | ALDH1A1 (0.67) | ALDH1A1TDP1L3MBTL1CYP3A4CYP2C9 | |
| Ethyl Chloride SCHEMBL2150451 | 0.88 | ALDH1A1 (0.52) | ALDH1A1TDP1L3MBTL1CYP3A4CYP2C9 | |
| Iodomethane SCHEMBL2149831 | 0.87 | ALDH1A1 (0.57) | ALDH1A1TDP1L3MBTL1CYP3A4CYP2C9 | |
| Methyl Alcohol SCHEMBL2150847 | 0.87 | ALDH1A1 (0.57) | ALDH1A1TDP1L3MBTL1CYP3A4CYP2C9 | |
| SCHEMBL28322890 | 0.87 | ALDH1A1 (0.57) | ALDH1A1TDP1L3MBTL1CYP3A4CYP2C9 | |
| Fluoromethane SCHEMBL2149463 | 0.87 | ALDH1A1 (0.57) | ALDH1A1TDP1L3MBTL1CYP3A4CYP2C9 | |
| Bromomethane SCHEMBL2150375 | 0.87 | ALDH1A1 (0.57) | ALDH1A1TDP1L3MBTL1CYP3A4CYP2C9 |
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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101463119-A | Reactive isocyanate compositions | EVONIK DEGUSSA GMBH (DE) | 2009-06-24 | — | — | CN | claimed |
| CN-101463221-A | Dual cure formulations with components comprising uretdione groups | EVONIK DEGUSSA GMBH (DE) | 2009-06-24 | — | — | CN | claimed |
| CN-101139461-A | Low-temperature-curable polyurethane compositions containing uretdione groups and with quaternary ammonium halides | DEGUSSA (DE) | 2008-03-12 | — | — | CN | claimed |
| CN-108863966-A | The method for preparing the trimer and/or oligomer of diisocyanate | 赢创德固赛有限公司 | 2018-11-23 | — | — | CN | disclosed |
| US-9290656-B2 | Polymerizable composition for polythiourethane optical material | MITSUI CHEMICALS, INC. (JP) | 2016-03-22 | — | — | US | disclosed |
| CN-102977309-B | Polymerizable composition for polythiourethane optical material, polythiourethane optical material obtained from the polymerizable composition, and polymerization catalyst for polythiourethane optical material | MITSU CHEMICALS INC | 2015-04-15 | — | — | CN | disclosed |
| CN-101497686-B | Dryblend process for preparing high-reactivity polyurethane compositions containing uretdione groups | EVONIK DEGUSSA GMBH (DE) | 2014-10-22 | — | — | CN | disclosed |
| EP-2341091-B1 | POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, OPTICAL MATERIAL, AND METHOD FOR PREPARING THE OPTICAL MATERIAL | MITSUI CHEMICALS INC (JP) | 2013-12-04 | — | — | EP | disclosed |
| CN-102066450-B | Polymerizable composition for polythiourethane optical material, polythiourethane optical material obtained from the polymerizable composition, and polymerization catalyst for polythiourethane optical material | MITSUI CHEMICALS INC | 2013-11-06 | — | — | CN | disclosed |
| CN-102143984-B | Polymerizable compound for optical material, optical material, and optical material manufacturing method | MITSUI CHEMICALS INC | 2013-08-21 | — | — | CN | disclosed |
| EP-1988109-B1 | POLYMERIZABLE COMPOSITION FOR POLYTHIOURETHANE OPTICAL MATERIAL | MITSUI CHEMICALS INC (JP) | 2013-05-29 | — | — | EP | disclosed |
| CN-101384636-A | Polymerizable composition for polythiourethane optical material | MITSUI CHEMICALS INC (JP) | 2009-03-11 | — | — | CN | disclosed |
| EP-1988109-A1 | POLYMERIZABLE COMPOSITION FOR POLYTHIOURETHANE OPTICAL MATERIAL | Mitsui Chemicals, Inc. (JP) | 2008-11-05 | — | — | EP | disclosed |
| CN-101139461-A | Low-temperature-curable polyurethane compositions containing uretdione groups and with quaternary ammonium halides | DEGUSSA (DE) | 2008-03-12 | — | — | CN | disclosed |
| CN-1328600-C | Composition for optical material | MITSUBISHI GAS CHEMICAL CO (JP) | 2007-07-25 | — | — | CN | disclosed |
| CN-1271121-C | Polymerization regulators, and compositions for resin | MITSUBISHI GAS CHEMICAL CO (JP) | 2006-08-23 | — | — | CN | disclosed |
| CN-1261773-C | Composition for optical material | MITSUBISHI GAS CHEMICAL CO (JP) | 2006-06-28 | — | — | CN | disclosed |
| CN-1471645-A | Composition for optical material | 三菱瓦斯化学株式会社 | 2004-01-28 | — | — | CN | disclosed |
| CN-1462290-A | Polymerization regulator and composition for resin | MITSUBISHI GAS CHEMICAL CO (JP) | 2003-12-17 | — | — | CN | disclosed |
| CN-1459031-A | Composition for optical material | MITSUBISHI GAS CHEMICAL CO (JP) | 2003-11-26 | — | — | CN | disclosed |