Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Diethanolamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 1/20 | 0.35 |
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.33 |
| ▸ | S1PR4 | O95977 | 5/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.33 |
| ▸ | MMP2 | P08253 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MMP1 | P03956 | 2/20 | 0.33 |
| ▸ | MMP3 | P08254 | 2/20 | 0.33 |
| ▸ | MMP9 | P14780 | 2/20 | 0.33 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | PAOX | Q6QHF9 | 2/20 | 0.31 |
| ▸ | PNP | P00491 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| Diethanolamine SCHEMBL9790976 | 0.89 | FFAR3 (0.44) | FFAR3LCKFYNALDH1A1KDM4E | |
| Diethanolamine SCHEMBL502768 | 0.89 | FFAR3 (0.44) | FFAR3LCKFYNALDH1A1KDM4E | |
| Acetic Acid SCHEMBL3927926 | 0.87 | FYN (0.41) | FFAR3LCKFYNALDH1A1KDM4E | |
| Diethanolamine SCHEMBL29053961 | 0.87 | FFAR3 (0.41) | FFAR3LCKFYNALDH1A1KDM4E | |
| Diethanolamine SCHEMBL3630770 | 0.87 | FFAR3 (0.41) | FFAR3LCKFYNALDH1A1KDM4E | |
| Acetic Acid SCHEMBL3841810 | 0.87 | FYN (0.41) | FFAR3LCKFYNALDH1A1KDM4E | |
| Acetic Acid SCHEMBL3929709 | 0.87 | FYN (0.41) | FFAR3LCKFYNALDH1A1KDM4E | |
| Diethanolamine SCHEMBL11454426 | 0.87 | FFAR3 (0.41) | FFAR3LCKFYNALDH1A1KDM4E | |
| Diethanolamine SCHEMBL1833785 | 0.87 | S1PR2 (0.34) | FYNS1PR2S1PR4S1PR1S1PR3 | |
| Diethanolamine SCHEMBL1831509 | 0.87 | S1PR2 (0.34) | FYNS1PR2S1PR4S1PR1S1PR3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109576037-B | Refrigerator oil, refrigerator oil composition and application thereof | 珠海格力节能环保制冷技术研究中心有限公司 | 2023-06-13 | — | — | CN | claimed |
| CN-109576037-A | A kind of refrigerator oil, refrigerated machine oil composition and its application | 珠海格力节能环保制冷技术研究中心有限公司 | 2019-04-05 | — | — | CN | claimed |
| CN-109576037-B | Refrigerator oil, refrigerator oil composition and application thereof | 珠海格力节能环保制冷技术研究中心有限公司 | 2023-06-13 | — | — | CN | disclosed |
| CN-112300851-A | Refrigerating machine oil composition | 珠海格力节能环保制冷技术研究中心有限公司 | 2021-02-02 | — | — | CN | disclosed |
| CN-109576037-A | A kind of refrigerator oil, refrigerated machine oil composition and its application | 珠海格力节能环保制冷技术研究中心有限公司 | 2019-04-05 | — | — | CN | disclosed |