Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.36 |
| ▸ | SHBG | P04278 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HRH2 | P25021 | 2/20 | 0.31 |
| ▸ | HRH1 | P35367 | 2/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.31 |
| ▸ | REN | P00797 | 1/20 | 0.31 |
| ▸ | ACE | P12821 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 2/20 | 0.31 |
| ▸ | CA1 | P00915 | 2/20 | 0.31 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | MMP2 | P08253 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2180612 | 0.88 | SHBG (0.45) | ALDH1A1EPHX1SHBGSMN1; SMN2EPHX2 | |
| SCHEMBL1208925 | 0.85 | ALDH1A1 (0.55) | ALDH1A1EPHX1SHBGSMN1; SMN2CYP2C19 | |
| SCHEMBL8651989 | 0.85 | ALDH1A1 (0.55) | ALDH1A1EPHX1SHBGSMN1; SMN2CYP2C19 | |
| SCHEMBL6808670 | 0.85 | ALDH1A1 (0.55) | ALDH1A1EPHX1SHBGSMN1; SMN2CYP2C19 | |
| SCHEMBL4093508 | 0.79 | SHBG (0.48) | ALDH1A1EPHX1SHBGSMN1; SMN2TDP1 | |
| SCHEMBL5967438 | 0.75 | — | — | |
| SCHEMBL28014448 | 0.74 | ALDH1A1 (0.39) | ALDH1A1EPHX1SHBGSMN1; SMN2CYP2C9 | |
| SCHEMBL11453751 | 0.73 | SHBG (0.43) | ALDH1A1EPHX1SHBGSMN1; SMN2EPHX2 | |
| SCHEMBL5682022 | 0.73 | SMN1; SMN2 (0.44) | ALDH1A1EPHX1SHBGSMN1; SMN2CYP2C9 | |
| SCHEMBL10646074 | 0.73 | SHBG (0.59) | ALDH1A1EPHX1SHBGSMN1; SMN2EPHX2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1447102-B1 | Cyclohexylethan-1-yl ester mixtures as malodour counteractants and methods for using same | INT FLAVORS & FRAGRANCES INC (US) | 2008-06-04 | — | — | EP | claimed |