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 | 2/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL2703 | 0.91 | — | — | |
| SCHEMBL1416868 | 0.91 | — | — | |
| SCHEMBL1416856 | 0.91 | — | — | |
| Propylene Glycol SCHEMBL8505000 | 0.84 | TDP1 (0.50) | TDP1TSHRSMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL27907062 | 0.82 | TDP1 (0.42) | TDP1MAPK1HSD17B10TSHR | |
| SCHEMBL535994 | 0.81 | TDP1 (0.56) | TDP1MAPK1HSD17B10TSHRSMN1; SMN2 | |
| SCHEMBL137830 | 0.81 | TDP1 (0.56) | TDP1MAPK1HSD17B10TSHRSMN1; SMN2 | |
| Propylene Glycol SCHEMBL412141 | 0.81 | TDP1 (0.53) | TDP1MAPK1HSD17B10TSHRLMNA | |
| SCHEMBL2512363 | 0.81 | TDP1 (0.56) | TDP1MAPK1HSD17B10TSHRSMN1; SMN2 | |
| Propylene Glycol SCHEMBL8846313 | 0.80 | TDP1 (0.46) | TDP1HSD17B10TSHRSMN1; SMN2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-5591875-A | REACTING OLEFIN WITH HYDROGEN PEROXIDE, TITANIUM MOLECULAR SIEVE | LYONDELL CHEMICAL TECHNOLOGY, L.P. | 1997-01-07 | — | — | US | disclosed |