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 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 4/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | GABRP | O00591 | 2/20 | 0.32 |
| ▸ | GABRD | O14764 | 2/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.32 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.32 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.32 |
| ▸ | GABRE | P78334 | 2/20 | 0.32 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.32 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.32 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.32 |
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 SCHEMBL7907781 | 1.00 | TDP1 (0.53) | TDP1ALDH1A1MAPTTSHRPAX8 | |
| Propylene Glycol SCHEMBL27851898 | 0.91 | TDP1 (0.43) | TDP1ALDH1A1MAPTTSHRGABRP | |
| Propylene Glycol SCHEMBL1930686 | 0.91 | TDP1 (0.43) | TDP1ALDH1A1MAPTTSHRGABRP | |
| Propylene Glycol SCHEMBL8832136 | 0.83 | — | — | |
| Acrylamide SCHEMBL20380116 | 0.82 | TSHR (0.55) | TDP1ALDH1A1MAPTTSHRPAX8 | |
| Acrylamide SCHEMBL8678013 | 0.82 | TSHR (0.55) | TDP1ALDH1A1MAPTTSHRPAX8 | |
| Propylene Glycol SCHEMBL7708272 | 0.80 | — | — | |
| Propylene Glycol SCHEMBL27548540 | 0.80 | — | — | |
| Propylene Glycol SCHEMBL8562905 | 0.78 | TDP1 (0.59) | TDP1ALDH1A1TSHROR51E2TP53 | |
| Propylene Glycol SCHEMBL9016119 | 0.78 | TDP1 (0.59) | TDP1ALDH1A1TSHROR51E2TP53 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110136944-A1 | COPOLYMERS BASED ON UNSATURATED MONO- OR DICARBOXYLIC ACID DERIVATIVES AND OXYALKYLENEGLYCOL-ALKENYL ETHERS, PROCESSES FOR THE PRODUCTION AND USE THEREOF | EVONIK DEGUSSA GMBH (DE) | 2011-06-09 | — | — | US | disclosed |
| US-20070161724-A1 | Copolymers based on unsaturated mono-or dicarboxylic acid derivatives and oxyalkyleneglycol-alkenyl ethers, method for the production and use thereof | EVONIK DEGUSSA GMBH (DE) | 2007-07-12 | — | — | US | disclosed |