Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 6/20 | 0.39 |
| ▸ | CA1 | P00915 | 6/20 | 0.39 |
| ▸ | CA2 | P00918 | 6/20 | 0.39 |
| ▸ | CA7 | P43166 | 6/20 | 0.39 |
| ▸ | CA9 | Q16790 | 6/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 6/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6053385 | 0.79 | TSHR (0.39) | TSHRALDH1A1HSD17B10CA12CA1 | |
| Diethyl Phthalate SCHEMBL5306972 | 0.63 | TSHR (1.00) | TSHRALDH1A1HSD17B10CA12CA1 | |
| Diethyl Phthalate SCHEMBL22296 | 0.63 | TSHR (1.00) | TSHRALDH1A1HSD17B10CA12CA1 | |
| Diethyl Phthalate SCHEMBL29404255 | 0.63 | TSHR (1.00) | TSHRALDH1A1HSD17B10CA12CA1 | |
| SCHEMBL4919337 | 0.63 | TSHR (0.41) | TSHRALDH1A1HSD17B10CA12CA1 | |
| SCHEMBL5282811 | 0.63 | CA1 (0.43) | TSHRALDH1A1CA12CA1CA2 | |
| Diethyl Phthalate SCHEMBL9311945 | 0.63 | TSHR (0.88) | TSHRALDH1A1HSD17B10CA12CA1 | |
| SCHEMBL11008658 | 0.62 | ALDH1A1 (0.62) | TSHRALDH1A1HSD17B10CA12CA1 | |
| SCHEMBL87450 | 0.62 | CA1 (0.83) | TSHRALDH1A1CA12CA1CA2 | |
| SCHEMBL1664013 | 0.62 | CA12 (0.75) | TSHRALDH1A1CA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6498200-B1 | OXIRANE OR OXETANE RING COMPOUND, ORGANIC PEROXIDE, ONIUM SALT CATALYST, AND ALKALINE FILLER; CURES RAPIDLY; STABLE DOES NOT CAUSE INCREASE IN ELECTROCONDUCTIVITY OR CORROSION; SEALANT, BINDER, ENCAPSULATING AGENT, DIELECTRIC FILM | NAMICS CORPORATION (JP) | 2002-12-24 | — | — | US | claimed |
| EP-0873687-B2 | Disinfecting and fungicidal composition based on peracetic acid and an amine oxide | CHEMOXAL SA (FR) | 2006-04-26 | — | — | EP | disclosed |
| EP-0873687-B1 | Disinfecting and fungicidal composition based on peracetic acid and an amine oxide | CHEMOXAL SA (FR) | 2002-06-05 | — | — | EP | disclosed |
| EP-0873687-A1 | Disinfecting and fungicidal composition based on peracetic acid and an amine oxide | CHEMOXAL SA (FR) | 1998-10-28 | — | — | EP | disclosed |