Known targets — ChEMBL curated mechanism
CHRM1DRD2DRD3DRD4HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR2APDE3ASIGMAR1
The experimentally established mechanism targets of Dodecane. 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 | |
|---|---|---|---|---|
| ▸ | HDAC11 known ✓ | Q96DB2 | 5/20 | 0.52 |
| ▸ | PDE3A known ✓ | Q14432 | 1/20 | 0.52 |
| ▸ | GPR84 | Q9NQS5 | 10/20 | 0.62 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.62 |
| ▸ | TP53 | P04637 | 1/20 | 0.61 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.56 |
| ▸ | PPARD | Q03181 | 7/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | LCK | P06239 | 1/20 | 0.54 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.54 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.54 |
| ▸ | PPARG | P37231 | 6/20 | 0.52 |
| ▸ | PPARA | Q07869 | 6/20 | 0.52 |
| ▸ | TSHR | P16473 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | TLR2 | O60603 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | FABP4 | P15090 | 2/20 | 0.52 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.52 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| Tetradecane SCHEMBL28188856 | 1.00 | GPR84 (0.62) | GPR84FFAR1TP53ACE2PPARD | |
| Hexadecane SCHEMBL29288627 | 1.00 | GPR84 (0.62) | GPR84FFAR1TP53ACE2PPARD | |
| Lactic Acid SCHEMBL8907767 | 0.97 | TP53 (0.65) | GPR84FFAR1TP53ACE2PPARD | |
| Myristyl Alcohol SCHEMBL27503558 | 0.91 | LMNA (0.59) | GPR84FFAR1TP53ACE2PPARD | |
| Myristyl Alcohol SCHEMBL28076392 | 0.91 | LMNA (0.59) | GPR84FFAR1TP53ACE2PPARD | |
| Cetostearyl Alcohol SCHEMBL28027646 | 0.91 | LMNA (0.59) | GPR84FFAR1TP53ACE2PPARD | |
| 1-Hexanol SCHEMBL27745635 | 0.91 | LMNA (0.59) | GPR84FFAR1TP53ACE2PPARD | |
| Decanol SCHEMBL28007952 | 0.91 | LMNA (0.59) | GPR84FFAR1TP53ACE2PPARD | |
| Lactic Acid SCHEMBL29116772 | 0.91 | LMNA (0.59) | GPR84FFAR1TP53ACE2PPARD | |
| Octanol SCHEMBL27745636 | 0.91 | LMNA (0.59) | GPR84FFAR1TP53ACE2PPARD |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1412043-A4 | AZEOTROPIC DISTILLATION OF CYCLIC ESTERS OF HYDROXY ORGANIC ACIDS | STALEY MFG CO A E (US) | 2004-09-29 | — | — | EP | disclosed |
| EP-1370335-A4 | AZEOTROPIC DISTILLATION PROCESS FOR PRODUCING ORGANIC ACIDS OR ORGANIC ACID AMIDES | STALEY MFG CO A E (US) | 2004-08-11 | — | — | EP | disclosed |
| EP-1412043-A2 | AZEOTROPIC DISTILLATION OF CYCLIC ESTERS OF HYDROXY ORGANIC ACIDS | A.E. STALEY MANUFACTURING COMPANY (US) | 2004-04-28 | — | — | EP | disclosed |
| EP-1370335-A1 | AZEOTROPIC DISTILLATION PROCESS FOR PRODUCING ORGANIC ACIDS OR ORGANIC ACID AMIDES | A.E. STALEY MANUFACTURING COMPANY (US) | 2003-12-17 | — | — | EP | disclosed |
| WO-2003004126-A2 | AZEOTROPIC DISTILLATION OF CYCLIC ESTERS OF HYDROXY ORGANIC ACIDS | A.E. STALEY MANUFACTURING CO. (US) | 2003-01-16 | — | — | WO | disclosed |
| WO-2002074402-A1 | AZEOTROPIC DISTILLATION PROCESS FOR PRODUCING ORGANIC ACIDS OR ORGANIC ACID AMIDES | A.E. STALEY MANUFACTURING CO. (US) | 2002-09-26 | — | — | WO | disclosed |