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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.40 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MME | P08473 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.33 |
| ▸ | NAALAD2 | Q9Y3Q0 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| Propylene Glycol SCHEMBL27714310 | 0.89 | TDP1 (0.43) | TDP1TGFBR1OR51E2TP53MME | |
| Propylene Glycol SCHEMBL28400237 | 0.86 | TDP1 (0.59) | TDP1TGFBR1OR51E2TP53MME | |
| Propylene Glycol SCHEMBL1274149 | 0.86 | TDP1 (0.59) | TDP1TGFBR1OR51E2TP53MME | |
| Propylene Glycol SCHEMBL472051 | 0.84 | ALDH1A1 (0.50) | TDP1TGFBR1OR51E2TP53MME | |
| Propylene Glycol SCHEMBL28261417 | 0.83 | TDP1 (0.56) | TDP1TGFBR1OR51E2TP53MME | |
| SCHEMBL9572358 | 0.83 | ALDH1A1 (0.44) | TDP1TP53TSHRCYP2D6CYP2C19 | |
| Propylene Glycol SCHEMBL28102165 | 0.83 | TDP1 (0.56) | TDP1TGFBR1OR51E2TP53MME | |
| SCHEMBL9573739 | 0.83 | TP53 (0.38) | TDP1TP53MMETSHRCYP2D6 | |
| Propylene Glycol SCHEMBL58534 | 0.83 | TDP1 (0.56) | TDP1TGFBR1OR51E2TP53MME | |
| Butanol SCHEMBL7159823 | 0.83 | TSHR (0.56) | TP53TSHRCYP2D6CYP2C19ALDH1A1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103980124-B | The synthetic method of ionic liquid-catalyzed propylene carbonate Synthesis of dimethyl carbonate | TIANJIN UNIVERSITY (CN) | 2016-04-20 | — | — | CN | disclosed |
| CN-104119206-B | A kind of metal hydro-thermal reduction glycerine produces the method for propylene glycol | TONGJI UNIVERSITY (CN) | 2016-04-06 | — | — | CN | disclosed |
| CN-104119206-A | Method for producing propylene glycol by hydrothermally reducing glycerol with metals | UNIV TONGJI | 2014-10-29 | — | — | CN | disclosed |
| CN-101704719-B | Method for preparing medical-grade propylene glycol | HUNAN ERKANG PHARMACEUTICAL COMPANY LTD | 2013-05-01 | — | — | CN | disclosed |
| CN-102898277-A | Method and device for preparing propylene glycol for use in preparation of dimethyl carbonate from propylene carbonate and methanol | SHANDONG DEPU CHEMICAL INDUSTRY SCIENCE AND TECHNOLOGY CO LTD | 2013-01-30 | — | — | CN | disclosed |
| EP-2536819-A1 | ARRAY OF MICROMOLDED STRUCTURES FOR SORTING ADHERENT CELLS | The University of North Carolina At Chapel Hill (US) | 2012-12-26 | — | — | EP | disclosed |
| WO-2011103143-A1 | ARRAY OF MICROMOLDED STRUCTURES FOR SORTING ADHERENT CELLS | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2011-08-25 | — | — | WO | disclosed |
| CN-101704719-A | Method for preparing medical-grade propylene glycol | HUNAN ERKANG PHARMACEUTICAL CO | 2010-05-12 | — | — | CN | disclosed |