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 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 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 | |
|---|---|---|---|---|
| Glycerin SCHEMBL28634331 | 0.86 | LMNA (0.43) | CA1CA2CA7CYP2D6TSHR | |
| Propylene Glycol SCHEMBL278652 | 0.83 | TDP1 (0.50) | TDP1CA1CA2CA7CYP2D6 | |
| SCHEMBL28450687 | 0.82 | TDP1 (0.38) | TDP1CA1CA2CA7 | |
| Allyl Alcohol SCHEMBL28326968 | 0.82 | TSHR (0.39) | TDP1CA1CA2CA7TSHR | |
| Ethylene Glycol SCHEMBL1803897 | 0.79 | — | — | |
| Allyl Alcohol SCHEMBL28161605 | 0.79 | — | — | |
| Propylene Glycol SCHEMBL8520043 | 0.79 | TDP1 (0.46) | TDP1CA1CA2CA7CYP2D6 | |
| SCHEMBL41707 | 0.79 | — | — | |
| SCHEMBL28078236 | 0.79 | MEN1 (0.35) | CA1CA2TSHR | |
| SCHEMBL11806767 | 0.79 | CA1 (0.47) | CA1CA2CA7CYP2D6TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100430429-C | Cement admixture and cement composition | NIPPON CATALYTIC CHEM IND (JP) | 2008-11-05 | — | — | CN | disclosed |
| CN-1768015-A | Cement admixture and cement composition | NIPPON CATALYTIC CHEM IND (JP) | 2006-05-03 | — | — | CN | disclosed |
| US-6187887-B1 | BASED ON (METH)ACRYLAMIDE ALKYL SULFONIC ACIDS AND (METH)ACRYLAMIDE OR N-VINYL COMPOUNDS; USE AS ADDITIVES IN AQUEOUS BUILDING MATERIAL MIXES OR FOR WATER-BASED PAINTING AND COATING SYSTEMS | SKW BAUCHEMIE GMBH (DE) | 2001-02-13 | — | — | US | disclosed |