Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.48 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.48 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.48 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | TTR | P02766 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9580587 | 1.00 | CHRM2 (0.48) | CHRM2CHRM4CHRM5CHRM3PDK1 | |
| SCHEMBL895933 | 1.00 | CHRM2 (0.48) | CHRM2CHRM4CHRM5CHRM3PDK1 | |
| SCHEMBL18183279 | 1.00 | CHRM2 (0.48) | CHRM2CHRM4CHRM5CHRM3PDK1 | |
| Dioxane SCHEMBL17731142 | 1.00 | CHRM2 (0.48) | CHRM2CHRM4CHRM5CHRM3PDK1 | |
| SCHEMBL1246485 | 1.00 | CHRM2 (0.48) | CHRM2CHRM4CHRM5CHRM3PDK1 | |
| Dioxane SCHEMBL10605073 | 1.00 | CHRM2 (0.48) | CHRM2CHRM4CHRM5CHRM3PDK1 | |
| Dioxane SCHEMBL17731000 | 1.00 | CHRM2 (0.48) | CHRM2CHRM4CHRM5CHRM3PDK1 | |
| SCHEMBL10896776 | 1.00 | CHRM2 (0.48) | CHRM2CHRM4CHRM5CHRM3PDK1 | |
| SCHEMBL1245155 | 1.00 | CHRM2 (0.48) | CHRM2CHRM4CHRM5CHRM3PDK1 | |
| SCHEMBL147417 | 0.97 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5047563-A | Ionophores | MILES INC. (US) | 1991-09-10 | — | — | US | claimed |
| EP-0306802-B1 | CHIRAL CROWN ETHERS | MILES INC. (US) | 1991-05-15 | — | — | EP | claimed |
| EP-0306802-A1 | Chiral crown ethers | MILES INC. (US) | 1989-03-15 | — | — | EP | claimed |
| JP-1104067-A | — | — | None | — | — | JP | disclosed |
| WO-2016160741-A1 | SOLID PHASE EXTRACTION, DERIVATIZATION WITH CROWN ETHERS, AND MASS SPECTROMETRY, METHODS, REAGENTS AND KITS | QUANTALYTICAL LABS INC. (US) | 2016-10-06 | — | — | WO | disclosed |
| US-5133934-A | Enantiomorphs of bis/12-crown-4-methyl/ dialkyl malonate, a carrier and ionophore | MILES INC. (US) | 1992-07-28 | — | — | US | disclosed |
| US-5047563-A | Ionophores | MILES INC. (US) | 1991-09-10 | — | — | US | disclosed |
| EP-0306802-B1 | CHIRAL CROWN ETHERS | MILES INC. (US) | 1991-05-15 | — | — | EP | disclosed |
| JP-H01104067-A | COMPOSITION FOR MEASURING SODIUM ION | MILES INC | 1989-04-21 | — | — | JP | disclosed |
| EP-0306802-A1 | Chiral crown ethers | MILES INC. (US) | 1989-03-15 | — | — | EP | disclosed |