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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 4/20 | 0.38 |
| ▸ | CETP | P11597 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 2/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | ANPEP | P15144 | 1/20 | 0.36 |
| ▸ | LAP3 | P28838 | 1/20 | 0.36 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.35 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6560517 | 0.85 | LMNA (0.49) | LMNACYP2D6TDP1TRPA1CETP | |
| Ethylene Glycol SCHEMBL6559749 | 0.84 | ALDH1A1 (0.46) | LMNACYP2D6TDP1ALDH1A1RECQL | |
| SCHEMBL10405698 | 0.81 | CA4 (0.48) | CYP2D6TDP1ALDH1A1PPARGPPARA | |
| SCHEMBL93074 | 0.81 | CA4 (0.48) | CYP2D6TDP1ALDH1A1PPARGPPARA | |
| Diphenylether SCHEMBL50452 | 0.79 | LMNA (0.57) | LMNATDP1ALDH1A1NPY5R | |
| Ammonia Solution, Strong SCHEMBL27478584 | 0.79 | CA4 (0.46) | CYP2D6TDP1ALDH1A1PPARGPPARA | |
| Phosphine SCHEMBL20897416 | 0.79 | CA4 (0.46) | CYP2D6TDP1ALDH1A1PPARGPPARA | |
| Diphenylether SCHEMBL28593325 | 0.78 | LMNA (0.55) | LMNATDP1ALDH1A1NPY5R | |
| Anisole SCHEMBL6558891 | 0.78 | CA4 (0.61) | LMNATDP1ALDH1A1 | |
| Di(Hydroxyethyl)Ether SCHEMBL6559768 | 0.77 | ALDH1A1 (0.50) | TDP1ALDH1A1RECQLPPARGPPARA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0735403-B1 | Liquid crystal orienting agent | JSR CORP (JP) | 2004-03-17 | — | — | EP | disclosed |
| US-5700860-A | Liquid crystal orienting agent | JAPAN SYNTHETIC RUBBER CO., LTD. (JP) | 1997-12-23 | — | — | US | disclosed |
| EP-0735403-A1 | Liquid crystal orienting agent | JAPAN SYNTHETIC RUBBER CO., LTD. (JP) | 1996-10-02 | — | — | EP | disclosed |