Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of 1,5-Pentanediol. 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 | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.65 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.65 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.65 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | FNTA | P49354 | 1/20 | 0.46 |
| ▸ | FNTB | P49356 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL28326314 | 1.00 | GPR84 (0.65) | GPR84FFAR1FFAR4CAMK2ALMNA | |
| Bicarbonate SCHEMBL28327101 | 1.00 | GPR84 (0.65) | GPR84FFAR1FFAR4CAMK2ALMNA | |
| 1,6-Hexanediol SCHEMBL29109662 | 1.00 | GPR84 (0.65) | GPR84FFAR1FFAR4CAMK2ALMNA | |
| 1,6-Hexanediol SCHEMBL28737103 | 1.00 | GPR84 (0.65) | GPR84FFAR1FFAR4CAMK2ALMNA | |
| 1,6-Hexanediol SCHEMBL28984424 | 1.00 | GPR84 (0.65) | GPR84FFAR1FFAR4CAMK2ALMNA | |
| 1,5-Pentanediol SCHEMBL575113 | 1.00 | GPR84 (0.65) | GPR84FFAR1FFAR4CAMK2ALMNA | |
| Bicarbonate SCHEMBL28380298 | 1.00 | GPR84 (0.65) | GPR84FFAR1FFAR4CAMK2ALMNA | |
| 1,6-Hexanediol SCHEMBL628080 | 1.00 | GPR84 (0.65) | GPR84FFAR1FFAR4CAMK2ALMNA | |
| 1,6-Hexanediol SCHEMBL6707356 | 1.00 | GPR84 (0.65) | GPR84FFAR1FFAR4CAMK2ALMNA | |
| Bicarbonate SCHEMBL28191659 | 1.00 | GPR84 (0.65) | GPR84FFAR1FFAR4CAMK2ALMNA |
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-117467395-A | Crystalline thermoplastic polyurethane hot melt adhesive and preparation method and application thereof | 万华化学集团股份有限公司 | 2024-01-30 | — | — | CN | disclosed |