Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Dodecylamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 8/20 | 0.65 |
| ▸ | MEN1 | O00255 | 1/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.65 |
| ▸ | TSHR | P16473 | 1/20 | 0.65 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.65 |
| ▸ | CES2 | O00748 | 3/20 | 0.50 |
| ▸ | CES1 | P23141 | 3/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Octadecylamine SCHEMBL27992729 | 0.93 | DNM1 (0.62) | DNM1MEN1KMT2AALDH1A1TSHR | |
| Dodecylamine SCHEMBL11679893 | 0.93 | DNM1 (0.62) | DNM1MEN1KMT2AALDH1A1TSHR | |
| Dodecylamine SCHEMBL11763824 | 0.91 | DNM1 (0.59) | DNM1MEN1KMT2AALDH1A1TSHR | |
| Octadecylamine SCHEMBL28997993 | 0.91 | DNM1 (0.59) | DNM1MEN1KMT2AALDH1A1TSHR | |
| Dodecylamine SCHEMBL31081881 | 0.91 | DNM1 (0.59) | DNM1MEN1KMT2AALDH1A1TSHR | |
| Propionic Acid SCHEMBL27963799 | 0.91 | DNM1 (0.59) | DNM1MEN1KMT2AALDH1A1TSHR | |
| Octadecylamine SCHEMBL28396416 | 0.88 | DNM1 (0.62) | DNM1MEN1KMT2AALDH1A1TSHR | |
| Octadecylamine SCHEMBL29129920 | 0.88 | DNM1 (0.62) | DNM1MEN1KMT2AALDH1A1TSHR | |
| Acetic Acid SCHEMBL8170567 | 0.88 | DNM1 (0.62) | DNM1MEN1KMT2AALDH1A1TSHR | |
| Dodecylamine SCHEMBL7065536 | 0.88 | DNM1 (0.62) | DNM1MEN1KMT2AALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-102631312-A | Compound antithyroid gel for external application and preparation method thereof | YU ZHANG | 2012-08-15 | — | — | CN | claimed |
| CN-102091026-A | Externally applied antithyroid gel and preparation method thereof | WEI ZHANG | 2011-06-15 | — | — | CN | claimed |
| CN-102631312-A | Compound antithyroid gel for external application and preparation method thereof | YU ZHANG | 2012-08-15 | — | — | CN | disclosed |
| CN-102091026-A | Externally applied antithyroid gel and preparation method thereof | WEI ZHANG | 2011-06-15 | — | — | CN | disclosed |