Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | MMP1 | P03956 | 2/20 | 0.32 |
| ▸ | MMP2 | P08253 | 2/20 | 0.32 |
| ▸ | MMP9 | P14780 | 2/20 | 0.32 |
| ▸ | MMP8 | P22894 | 2/20 | 0.32 |
| ▸ | MMP13 | P45452 | 2/20 | 0.32 |
| ▸ | CES1 | P23141 | 4/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL576254 | 0.97 | ALDH1A1 (0.35) | ALDH1A1L3MBTL1CA1CA2MMP1 | |
| Trifluoromethanesulfonic Acid SCHEMBL575705 | 0.89 | ALDH1A1 (0.39) | ALDH1A1L3MBTL1CA1CA2CES1 | |
| SCHEMBL17022945 | 0.87 | CES1 (0.31) | CES1 | |
| Trifluoromethanesulfonic Acid SCHEMBL3266488 | 0.87 | ALDH1A1 (0.41) | ALDH1A1L3MBTL1CA1CA2MMP1 | |
| Propylene Glycol SCHEMBL575600 | 0.84 | TDP1 (0.43) | ALDH1A1L3MBTL1 | |
| SCHEMBL105340 | 0.84 | ALDH1A1 (0.43) | ALDH1A1L3MBTL1CA1CA2MMP1 | |
| SCHEMBL576289 | 0.83 | CA2 (0.38) | ALDH1A1L3MBTL1CA1CA2MMP1 | |
| Trifluoromethanesulfonic Acid SCHEMBL576231 | 0.82 | — | — | |
| SCHEMBL575406 | 0.81 | CA2 (0.45) | ALDH1A1L3MBTL1CA1CA2MMP1 | |
| SCHEMBL5960790 | 0.81 | ALDH1A1 (0.41) | ALDH1A1L3MBTL1CA1CA2MMP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2360771-B1 | Nonaqueous electrolytic solutions and nonaqueous-electrolyte batteries | MITSUBISHI CHEM CORP (JP) | 2015-04-29 | — | — | EP | disclosed |
| EP-2360771-A1 | Nonaqueous electrolytic solutions and nonaqueous-electrolyte batteries | Mitsubishi Chemical Corporation (JP) | 2011-08-24 | — | — | EP | disclosed |