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 | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.52 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.50 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | SLC22A6 | Q4U2R8 | 2/20 | 0.48 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.44 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.44 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.44 |
| ▸ | F13A1 | P00488 | 3/20 | 0.43 |
| ▸ | PPARG | P37231 | 2/20 | 0.42 |
| ▸ | PPARD | Q03181 | 2/20 | 0.42 |
| ▸ | PPARA | Q07869 | 2/20 | 0.42 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.42 |
| ▸ | TLR2 | O60603 | 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 | |
|---|---|---|---|---|
| Adipic Acid SCHEMBL28157377 | 1.00 | LMNA (0.55) | LMNANFKB1TSHRPMP22TRIM24 | |
| Adipic Acid SCHEMBL13279853 | 0.98 | LMNA (0.52) | LMNANFKB1TSHRPMP22TRIM24 | |
| SCHEMBL3271667 | 0.95 | TSHR (0.55) | LMNANFKB1TSHRPMP22TRIM24 | |
| Glutarate SCHEMBL28228789 | 0.93 | TRIM24 (0.52) | LMNANFKB1TSHRPMP22TRIM24 | |
| Hexanoate SCHEMBL11346787 | 0.88 | AKR1B1 (0.61) | LMNATSHRALDH1A1SLC22A6GPR84 | |
| Heptanoate SCHEMBL11884668 | 0.88 | GPR84 (0.65) | LMNATSHRALDH1A1SLC22A6GPR84 | |
| Succinic Acid SCHEMBL28133010 | 0.87 | ALDH1A1 (0.58) | LMNANFKB1TSHRPMP22TRIM24 | |
| Adipic Acid SCHEMBL8056736 | 0.84 | ALDH1A1 (0.41) | LMNANFKB1TSHRPMP22TRIM24 | |
| Stearic Acid SCHEMBL28143062 | 0.84 | GPR84 (0.61) | LMNATSHRALDH1A1SLC22A6GPR84 | |
| Adipic Acid SCHEMBL5608599 | 0.84 | ALDH1A1 (0.41) | LMNANFKB1TSHRPMP22TRIM24 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114057578-A | Derivative of 2-trifluoromethyl cyclopentanone and preparation method thereof | 浙江师范大学 | 2022-02-18 | — | — | CN | disclosed |
| CN-106883115-B | The method that one kettle way prepares adipic acid by cyclopentanone | 中国科学院大连化学物理研究所 | 2019-01-11 | — | — | CN | disclosed |