Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Dodecane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 11/20 | 0.47 |
| ▸ | CA9 | Q16790 | 8/20 | 0.47 |
| ▸ | CA12 | O43570 | 4/20 | 0.47 |
| ▸ | CA7 | P43166 | 4/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.47 |
| ▸ | CA1 | P00915 | 10/20 | 0.46 |
| ▸ | CA3 | P07451 | 2/20 | 0.44 |
| ▸ | CA4 | P22748 | 2/20 | 0.44 |
| ▸ | CA6 | P23280 | 2/20 | 0.44 |
| ▸ | CA5A | P35218 | 2/20 | 0.44 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.44 |
| ▸ | PPARA | Q07869 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | FAAH | O00519 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Octane SCHEMBL10634241 | 1.00 | EPHX1 (0.48) | EPHX1CA2CA9CA12CA7 | |
| Dodecane SCHEMBL28002175 | 0.97 | EPHX1 (0.46) | EPHX1CA2CA9CA12CA7 | |
| Trimethylammonium SCHEMBL27565841 | 0.93 | EPHX1 (0.43) | EPHX1CA2CA9CA12CA7 | |
| SCHEMBL5510168 | 0.91 | LMNA (0.59) | EPHX1CA2CA9CA12CA7 | |
| Docosanol SCHEMBL28338173 | 0.91 | LMNA (0.59) | EPHX1CA2CA9CA12CA7 | |
| Cetyl Alcohol SCHEMBL4774419 | 0.91 | LMNA (0.59) | EPHX1CA2CA9CA12CA7 | |
| Tridecan-1-Ol SCHEMBL8355424 | 0.91 | LMNA (0.59) | EPHX1CA2CA9CA12CA7 | |
| Myristyl Alcohol SCHEMBL7520310 | 0.91 | LMNA (0.59) | EPHX1CA2CA9CA12CA7 | |
| SCHEMBL9466845 | 0.89 | ALDH1A1 (0.56) | EPHX1CA2CA9CA12CA7 | |
| Dodecylamine SCHEMBL1639793 | 0.89 | DNM1 (0.56) | EPHX1CA2CA9CA1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-104490667-B | A kind of cosmetics containing the anti-skin ageing of loquat seed extract | 深圳市仙迪化妆品有限公司 | 2017-08-08 | — | — | CN | disclosed |
| CN-104490667-A | Cosmetic containing loquat seed extract for preventing skin aging | SHENZHEN SANDA COSMETIC CO LTD | 2015-04-08 | — | — | CN | disclosed |