Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Propylene 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 | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.34 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Propylene Glycol SCHEMBL7626719 | 1.00 | TDP1 (0.42) | TDP1TSHRCYP3A4MAPTCYP2C9 | |
| Propylene Glycol SCHEMBL28074364 | 0.88 | TSHR (0.38) | TDP1TSHRCYP3A4MAPTCYP2C9 | |
| Propylene Glycol SCHEMBL2910019 | 0.86 | TDP1 (0.43) | TDP1TSHRCYP3A4MAPTCYP2C9 | |
| Glycerin SCHEMBL3140831 | 0.86 | LMNA (0.38) | TDP1TSHRCYP3A4MAPTCACNA1B | |
| Glycerin SCHEMBL10632349 | 0.86 | LMNA (0.38) | TDP1TSHRCYP3A4MAPTCACNA1B | |
| Propylene Glycol SCHEMBL1075330 | 0.84 | CYP3A4 (0.42) | TDP1TSHRCYP3A4MAPTCYP2C9 | |
| Alcohol SCHEMBL18290914 | 0.83 | TSHR (0.47) | TDP1TSHRCYP3A4MAPTCACNA1B | |
| SCHEMBL7631790 | 0.83 | CYP3A4 (0.43) | TDP1TSHRCYP3A4MAPTCACNA1B | |
| Methyl Alcohol SCHEMBL27575508 | 0.83 | — | — | |
| SCHEMBL9929 | 0.82 | — | — |
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-106064416-A | Corrosion inhibitor for treating wood preservative process of | 西安旭皓环保科技有限责任公司 | 2016-11-02 | — | — | CN | disclosed |