Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.36 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.36 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.36 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| Methane SCHEMBL28942758 | 0.90 | TDP1 (0.48) | TDP1L3MBTL1ALDH1A1CYP3A4KDM4E | |
| SCHEMBL87643 | 0.89 | SIGMAR1 (0.46) | L3MBTL1ALDH1A1KDM4ESIGMAR1AOC3 | |
| SCHEMBL15423270 | 0.84 | SIGMAR1 (0.45) | L3MBTL1KDM4ESIGMAR1AOC3POLB | |
| SCHEMBL27689418 | 0.82 | SIGMAR1 (0.44) | L3MBTL1KDM4ESIGMAR1POLBAPOBEC3A | |
| SCHEMBL3894942 | 0.82 | TDP1 (0.52) | TDP1L3MBTL1ALDH1A1CYP3A4KDM4E | |
| SCHEMBL18979908 | 0.82 | CYP3A4 (0.56) | TDP1L3MBTL1ALDH1A1CYP3A4KDM4E | |
| SCHEMBL2444795 | 0.81 | ALDH1A1 (0.55) | TDP1L3MBTL1ALDH1A1CYP3A4KDM4E | |
| SCHEMBL28942753 | 0.80 | ALDH1A1 (0.50) | TDP1L3MBTL1ALDH1A1CYP3A4KDM4E | |
| SCHEMBL18979892 | 0.80 | CYP3A4 (0.62) | TDP1L3MBTL1ALDH1A1CYP3A4KDM4E | |
| SCHEMBL2440814 | 0.79 | ALDH1A1 (0.53) | TDP1L3MBTL1ALDH1A1CYP3A4KDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108191640-A | A kind of highly efficiency compositional polymerization inhibitor and its application in acroleic acid polymerization is inhibited | 万华化学集团股份有限公司 | 2018-06-22 | — | — | CN | claimed |
| EP-1960345-A1 | ALKYLATION OF N' -PHENYL-N-ALKYLPHENYLENEDIAMINES IN IONIC LIQUID, N' -PHENYL-N-ALKYL(ALKYLPHENYLENE) DIAMINES PRODUCED THEREBY, AND LUBRICANT COMPOSITIONS CONTAINING SAME | CHEMTURA CORPORATION (US) | 2008-08-27 | — | — | EP | disclosed |
| WO-2007070282-A1 | ALKYLATION OF N' -PHENYL-N-ALKYLPHENYLENEDIAMINES IN IONIC LIQUID, N' -PHENYL-N-ALKYL(ALKYLPHENYLENE) DIAMINES PRODUCED THEREBY, AND LUBRICANT COMPOSITIONS CONTAINING SAME | CHEMTURA CORPORATION (US) | 2007-06-21 | — | — | WO | disclosed |
| US-3954702-A | VULCANIZATION | DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DT) | 1976-05-04 | — | — | US | disclosed |