Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Dodecanoate. 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 | 7/20 | 0.53 |
| ▸ | PPARG | P37231 | 7/20 | 0.53 |
| ▸ | PPARD | Q03181 | 7/20 | 0.53 |
| ▸ | PPARA | Q07869 | 7/20 | 0.53 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.53 |
| ▸ | TSHR | P16473 | 4/20 | 0.53 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | TLR2 | O60603 | 2/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | FABP4 | P15090 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.53 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | ESR1 | P03372 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | PDE4A | P27815 | 1/20 | 0.53 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| Dodecanoate SCHEMBL6915217 | 0.89 | CES2 (0.50) | PPARGPPARAHDAC11FABP3CES2 | |
| Dodecane SCHEMBL10478943 | 0.88 | NR1I2 (0.58) | TSHRALDH1A1TDP1CES2CES1 | |
| Octane SCHEMBL6565412 | 0.88 | NR1I2 (0.58) | TSHRALDH1A1TDP1CES2CES1 | |
| Hexadecane SCHEMBL29039924 | 0.88 | NR1I2 (0.58) | TSHRALDH1A1TDP1CES2CES1 | |
| SCHEMBL29277540 | 0.85 | NR1I2 (0.54) | TSHRALDH1A1TDP1CES2CES1 | |
| Octanoic Acid SCHEMBL28645893 | 0.84 | ALDH1A1 (0.58) | GPR84PPARGPPARDPPARAHDAC11 | |
| Stearic Acid SCHEMBL27783966 | 0.84 | ALDH1A1 (0.58) | GPR84PPARGPPARDPPARAHDAC11 | |
| Dodecanoate SCHEMBL7290854 | 0.84 | ALDH1A1 (0.58) | GPR84PPARGPPARDPPARAHDAC11 | |
| SCHEMBL29145713 | 0.84 | TBXA2R (0.48) | HDAC11ALDH1A1TBXA2RNR1I2MAPT | |
| SCHEMBL27462829 | 0.84 | CES2 (0.48) | ALDH1A1KMT2AMEN1CES2CES1 |
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-1088853-B1 | Mg-Al-based hydrotalcite-type particles, chlorine-containing resin stabilizer and process for producing the particles | TODA KOGYO CORP (JP) | 2004-10-13 | — | — | EP | disclosed |
| US-6413639-B1 | LARGE PLATE SURFACE DIAMETER AND EXCELLENT STABILITY AND HEAT RESISTANCE | TODA KOGYO CORPORATION (JP) | 2002-07-02 | — | — | US | disclosed |
| EP-1088853-A1 | Mg-Al-based hydrotalcite-type particles, chlorine-containing resin stabilizer and process for producing the particles | Toda Kogyo Corporation (JP) | 2001-04-04 | — | — | EP | disclosed |