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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | PEPD | P12955 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.31 |
| ▸ | BTN3A1 | O00481 | 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 | |
|---|---|---|---|---|
| Ethylene Glycol SCHEMBL487247 | 0.84 | PEPD (0.41) | TSHRPEPDALDH1A1THRBCA4 | |
| SCHEMBL632415 | 0.84 | PEPD (0.48) | TSHRTDP1PEPDALDH1A1THRB | |
| SCHEMBL10394683 | 0.83 | TSHR (0.36) | TSHRTDP1 | |
| SCHEMBL28314244 | 0.82 | PEPD (0.46) | TSHRTDP1PEPDALDH1A1THRB | |
| Phosphoric Acid SCHEMBL28685360 | 0.82 | PEPD (0.46) | TSHRTDP1PEPDALDH1A1THRB | |
| SCHEMBL28119557 | 0.82 | PEPD (0.46) | TSHRTDP1PEPDALDH1A1THRB | |
| Benzene SCHEMBL5447044 | 0.79 | PEPD (0.42) | TSHRTDP1PEPDALDH1A1THRB | |
| Propylene Glycol SCHEMBL2881547 | 0.76 | TSHR (0.47) | TSHRTDP1ALDH1A1THRBTGFBR1 | |
| Methacrylic Acid SCHEMBL65012 | 0.76 | TDP1 (0.43) | TSHRTDP1PEPDTGFBR1 | |
| Propylene Glycol SCHEMBL21836014 | 0.76 | ALDH1A1 (0.65) | TSHRTDP1ALDH1A1THRBTGFBR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002068519-A2 | DECORATIVE SOLID SURFACING MATERIALS FILLED WITH CERAMIC MICROSPHERES | E.I. DUPONT DE NEMOURS AND COMPANY (US) | 2002-09-06 | — | — | WO | disclosed |