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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.44 |
| ▸ | GPR84 | Q9NQS5 | 8/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.43 |
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.43 |
| ▸ | PPARG | P37231 | 7/20 | 0.42 |
| ▸ | PPARD | Q03181 | 7/20 | 0.42 |
| ▸ | PPARA | Q07869 | 7/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TLR2 | O60603 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | FABP4 | P15090 | 2/20 | 0.42 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.42 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
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 SCHEMBL11507314 | 1.00 | TSHR (0.44) | TSHRLMNANFKB1PMP22GPR84 | |
| Isopropyl Alcohol SCHEMBL26665877 | 0.90 | TSHR (0.50) | TSHRLMNANFKB1PMP22GPR84 | |
| Glycerin SCHEMBL28714217 | 0.89 | FFAR4 (0.46) | TSHRLMNANFKB1PMP22GPR84 | |
| Glycerin SCHEMBL28492784 | 0.89 | FFAR4 (0.46) | TSHRLMNANFKB1PMP22GPR84 | |
| Glycerin SCHEMBL3683065 | 0.89 | FFAR4 (0.46) | TSHRLMNANFKB1PMP22GPR84 | |
| 1,3-Butanediol SCHEMBL11507257 | 0.88 | GPR84 (0.44) | TSHRLMNANFKB1PMP22GPR84 | |
| SCHEMBL3937778 | 0.86 | TSHR (0.55) | TSHRLMNANFKB1PMP22GPR84 | |
| Propylene Glycol SCHEMBL5035967 | 0.86 | TSHR (0.60) | TSHRLMNANFKB1PMP22GPR84 | |
| Azelaic Acid SCHEMBL347853 | 0.86 | TSHR (0.60) | TSHRLMNANFKB1PMP22GPR84 | |
| Sebacic Acid SCHEMBL347212 | 0.86 | TSHR (0.60) | TSHRLMNANFKB1PMP22GPR84 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4166163-A | SEMI-REACTIVE GLYCOL MONOCARBOXYLATE | TENNECO CHEMICALS, INC. (US) | 1979-08-28 | — | — | US | claimed |
| US-4428751-A | ALIPHATIC ESTERS | MILLIKEN RESEARCH CORPORATION (US) | 1984-01-31 | — | — | US | disclosed |
| US-4166163-A | SEMI-REACTIVE GLYCOL MONOCARBOXYLATE | TENNECO CHEMICALS, INC. (US) | 1979-08-28 | — | — | US | disclosed |
| US-4166163-A | SEMI-REACTIVE GLYCOL MONOCARBOXYLATE | TENNECO CHEMICALS, INC. (US) | 1979-08-28 | — | — | US | disclosed |