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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.62 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | ANPEP | P15144 | 3/20 | 0.35 |
| ▸ | LAP3 | P28838 | 3/20 | 0.35 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.35 |
| ▸ | GABBR2 | O75899 | 2/20 | 0.33 |
| ▸ | GABBR1 | Q9UBS5 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.33 |
| ▸ | FDPS | P14324 | 1/20 | 0.32 |
| ▸ | MMP1 | P03956 | 1/20 | 0.32 |
| ▸ | MMP8 | P22894 | 1/20 | 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 SCHEMBL22285873 | 0.97 | TDP1 (0.67) | TDP1TSHRALDH1A1ANPEPLAP3 | |
| Propylene Glycol SCHEMBL6852797 | 0.97 | TDP1 (0.67) | TDP1TSHRALDH1A1ANPEPLAP3 | |
| Propylene Glycol SCHEMBL315221 | 0.97 | TDP1 (0.67) | TDP1TSHRALDH1A1ANPEPLAP3 | |
| Propylene Glycol SCHEMBL28091290 | 0.94 | TDP1 (0.62) | TDP1TSHRALDH1A1ANPEPLAP3 | |
| Propylene Glycol SCHEMBL27549086 | 0.94 | TDP1 (0.62) | TDP1TSHRALDH1A1ANPEPLAP3 | |
| Propylene Glycol SCHEMBL29186483 | 0.94 | TDP1 (0.62) | TDP1TSHRALDH1A1ANPEPLAP3 | |
| Propylene Glycol SCHEMBL29249405 | 0.94 | TDP1 (0.62) | TDP1TSHRALDH1A1ANPEPLAP3 | |
| Propylene Glycol SCHEMBL4710370 | 0.91 | TDP1 (0.59) | TDP1TSHRALDH1A1ANPEPLAP3 | |
| Propylene Glycol SCHEMBL5486872 | 0.88 | TDP1 (0.62) | TDP1TSHRALDH1A1ANPEPLAP3 | |
| Propylene Glycol SCHEMBL28569058 | 0.88 | TDP1 (0.62) | TDP1TSHRALDH1A1ANPEPLAP3 |
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-0996436-A4 | PHARMACEUTICAL FORMULATIONS CONTAINING POORLY SOLUBLE DRUG SUBSTANCES | SANOFI SYNTHELABO (FR) | 2001-04-11 | — | — | EP | disclosed |
| EP-0996436-A1 | PHARMACEUTICAL FORMULATIONS CONTAINING POORLY SOLUBLE DRUG SUBSTANCES | SANOFI-SYNTHELABO (FR) | 2000-05-03 | — | — | EP | disclosed |
| WO-1998038987-A1 | PHARMACEUTICAL FORMULATIONS CONTAINING POORLY SOLUBLE DRUG SUBSTANCES | SANOFI-SYNTHELABO (FR) | 1998-09-11 | — | — | WO | disclosed |