Known targets — ChEMBL curated mechanism
CACNA1CCACNA1DCACNA1FCACNA1SDRD2HTR1BHTR1DHTR1F
The experimentally established mechanism targets of Triethylene Glycol. 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 | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.62 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.41 |
| ▸ | TET2 | Q6N021 | 6/20 | 0.39 |
| ▸ | TET3 | O43151 | 2/20 | 0.39 |
| ▸ | TET1 | Q8NFU7 | 1/20 | 0.39 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.37 |
| ▸ | KDM4A | O75164 | 2/20 | 0.37 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.37 |
| ▸ | KDM2A | Q9Y2K7 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Triethylene Glycol SCHEMBL30580745 | 1.00 | SMN1; SMN2 (0.62) | SMN1; SMN2MEN1KMT2ATSHRMAPK1 | |
| Malic Acid SCHEMBL27714812 | 0.98 | SMN1; SMN2 (0.65) | SMN1; SMN2MEN1KMT2ATSHRMAPK1 | |
| Triethylene Glycol SCHEMBL2953129 | 0.91 | SMN1; SMN2 (0.52) | SMN1; SMN2MEN1KMT2ATSHRMAPK1 | |
| Triethylene Glycol SCHEMBL2953118 | 0.91 | SMN1; SMN2 (0.52) | SMN1; SMN2MEN1KMT2ATSHRMAPK1 | |
| Diethylene Glycol Monoethyl Ether SCHEMBL9054038 | 0.91 | SMN1; SMN2 (0.52) | SMN1; SMN2MEN1KMT2ATSHRMAPK1 | |
| Diethylene Glycol Monoethyl Ether SCHEMBL2953116 | 0.91 | SMN1; SMN2 (0.52) | SMN1; SMN2MEN1KMT2ATSHRMAPK1 | |
| Malic Acid SCHEMBL2963355 | 0.91 | SMN1; SMN2 (0.52) | SMN1; SMN2MEN1KMT2ATSHRMAPK1 | |
| Malic Acid SCHEMBL2964150 | 0.89 | SMN1; SMN2 (0.54) | SMN1; SMN2MEN1KMT2ATSHRMAPK1 | |
| Malic Acid SCHEMBL2964326 | 0.89 | SMN1; SMN2 (0.54) | SMN1; SMN2MEN1KMT2ATSHRMAPK1 | |
| Triethylene Glycol SCHEMBL2960132 | 0.88 | SMN1; SMN2 (0.48) | SMN1; SMN2MEN1KMT2ATSHRMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102031529-B | For the manufacture of the anticorrosive additive of process, Its Preparation Method And Use | RHEIN CHEMIE RHEINAU GMBH (DE) | 2016-05-18 | — | — | CN | disclosed |