Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Adipic Acid. 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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | CYSLTR2 | Q9NS75 | 4/20 | 0.50 |
| ▸ | CYSLTR1 | Q9Y271 | 4/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.47 |
| ▸ | PRNP | P04156 | 1/20 | 0.47 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.46 |
| ▸ | LTB4R | Q15722 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Adipic Acid SCHEMBL5875328 | 1.00 | ALDH1A1 (0.61) | ALDH1A1CYSLTR2CYSLTR1HTTRXFP1 | |
| Adipic Acid SCHEMBL28641209 | 1.00 | ALDH1A1 (0.61) | ALDH1A1CYSLTR2CYSLTR1HTTRXFP1 | |
| Sebacic Acid SCHEMBL5875085 | 0.98 | ALDH1A1 (0.59) | ALDH1A1CYSLTR2CYSLTR1HTTRXFP1 | |
| Sebacic Acid SCHEMBL5875076 | 0.98 | ALDH1A1 (0.59) | ALDH1A1CYSLTR2CYSLTR1HTTRXFP1 | |
| Quinoline SCHEMBL5874797 | 0.96 | ALDH1A1 (0.61) | ALDH1A1CYSLTR2CYSLTR1HTTRXFP1 | |
| Quinoline SCHEMBL5874806 | 0.96 | ALDH1A1 (0.61) | ALDH1A1CYSLTR2CYSLTR1HTTRXFP1 | |
| Quinoline SCHEMBL5874815 | 0.93 | ALDH1A1 (0.65) | ALDH1A1CYSLTR2CYSLTR1HTTRXFP1 | |
| Quinoline SCHEMBL4733766 | 0.93 | ALDH1A1 (0.65) | ALDH1A1CYSLTR2CYSLTR1HTTRXFP1 | |
| Quinoline SCHEMBL5875240 | 0.92 | ALDH1A1 (0.52) | ALDH1A1ALOX15TBXAS1HDAC11 | |
| Quinoline SCHEMBL29172160 | 0.92 | ALDH1A1 (0.52) | ALDH1A1ALOX15TBXAS1HDAC11 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113527305-A | Pharmaceutically acceptable salts of quinoline TGF-beta 1 inhibitor and preparation method thereof | 南京圣和药物研发有限公司 | 2021-10-22 | — | — | CN | disclosed |
| US-7128976-B2 | Composition for film formation, method of film formation, and silica-based film | JSR CORPORATION (JP) | 2006-10-31 | — | — | US | disclosed |
| US-20030091838-A1 | Composition for film formation, method of film formation, and silica-based film | JSR CORPORATION (JP) | 2003-05-15 | — | — | US | disclosed |