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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL634629 | 0.82 | TSHR (0.41) | TSHR | |
| Propane SCHEMBL10975233 | 0.80 | HSD17B10 (0.40) | TDP1TSHRHSD17B10 | |
| Hydrochloric Acid SCHEMBL28824610 | 0.80 | THRB (0.37) | THRB | |
| Ethane SCHEMBL5181947 | 0.79 | TSHR (0.39) | TSHR | |
| SCHEMBL30539 | 0.79 | TSHR (0.44) | TSHR | |
| Lactic Acid SCHEMBL21219128 | 0.77 | TP53 (0.48) | — | |
| Butane SCHEMBL28675649 | 0.77 | TSHR (0.40) | THRBTSHR | |
| Propane SCHEMBL11787066 | 0.76 | ALDH1A1 (0.43) | THRBTSHR | |
| Trimethylammonium SCHEMBL5918857 | 0.76 | TSHR (0.37) | TSHR | |
| Water SCHEMBL1246621 | 0.76 | TSHR (0.41) | TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-114656615-A | Water-based cationic polyurethane curing agent | 付海晶 | 2022-06-24 | — | — | CN | claimed |