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 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.59 |
| ▸ | TSHR | P16473 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 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 | |
|---|---|---|---|---|
| Propylene Glycol SCHEMBL35797 | 0.97 | TDP1 (0.62) | TDP1TSHRALDH1A1HSD17B10USP2 | |
| Propylene Glycol SCHEMBL18285762 | 0.97 | TDP1 (0.62) | TDP1TSHRALDH1A1HSD17B10USP2 | |
| Propylene Glycol SCHEMBL4936361 | 0.97 | TDP1 (0.62) | TDP1TSHRALDH1A1HSD17B10USP2 | |
| Propylene Glycol SCHEMBL8231638 | 0.94 | TDP1 (0.59) | TDP1TSHRALDH1A1HSD17B10USP2 | |
| Propylene Glycol SCHEMBL3418653 | 0.92 | TDP1 (0.56) | TDP1TSHRALDH1A1HSD17B10USP2 | |
| Propylene Glycol SCHEMBL28174906 | 0.92 | TDP1 (0.56) | TDP1TSHRALDH1A1HSD17B10USP2 | |
| Propylene Glycol SCHEMBL93425 | 0.92 | TDP1 (0.56) | TDP1TSHRALDH1A1HSD17B10USP2 | |
| Propylene Glycol SCHEMBL15659730 | 0.92 | TDP1 (0.56) | TDP1TSHRALDH1A1HSD17B10USP2 | |
| Benzene SCHEMBL2865296 | 0.89 | TDP1 (0.53) | TDP1TSHRALDH1A1HSD17B10USP2 | |
| Propylene Glycol SCHEMBL2929808 | 0.89 | TDP1 (0.53) | TDP1TSHRALDH1A1HSD17B10USP2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1540126-A2 | SHALE HYDRATION INHIBITION AGENT AND METHOD OF USE | M-I L.L.C. (US) | 2005-06-15 | — | — | EP | disclosed |
| US-6857485-B2 | Shale hydration inhibition agent and method of use | M-I LLC (US) | 2005-02-22 | — | — | US | disclosed |
| WO-2004007897-A2 | SHALE HYDRATION INHIBITION AGENT AND METHOD OF USE | M-I L.L.C. (US) | 2004-01-22 | — | — | WO | disclosed |
| US-20030106718-A1 | Shale hydration inhibition agent and method of use | M-I L.L.C. | 2003-06-12 | — | — | US | disclosed |