Known targets — ChEMBL curated mechanism
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
The experimentally established mechanism targets of Piperonal. 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 | 4/20 | 0.77 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.77 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.77 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.48 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.48 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.48 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.48 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.48 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.48 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Piperonal SCHEMBL29318 | 0.88 | ALDH1A1 (1.00) | ALDH1A1TDP1HSD17B10CYP19A1MAPT | |
| Piperonal SCHEMBL29411164 | 0.88 | ALDH1A1 (1.00) | ALDH1A1TDP1HSD17B10CYP19A1MAPT | |
| Piperonal SCHEMBL1864802 | 0.88 | ALDH1A1 (1.00) | ALDH1A1TDP1HSD17B10CYP19A1MAPT | |
| Piperonal SCHEMBL28017062 | 0.86 | ALDH1A1 (0.96) | ALDH1A1TDP1HSD17B10CYP19A1MAPT | |
| Piperonal SCHEMBL5958791 | 0.86 | ALDH1A1 (0.96) | ALDH1A1TDP1HSD17B10CYP19A1MAPT | |
| Piperonal SCHEMBL9007249 | 0.83 | ALDH1A1 (0.82) | ALDH1A1TDP1HSD17B10CYP19A1MAPT | |
| Piperonal SCHEMBL16161395 | 0.83 | ALDH1A1 (0.82) | ALDH1A1TDP1HSD17B10MAPTMEN1 | |
| Piperonal SCHEMBL5839673 | 0.81 | ALDH1A1 (0.79) | ALDH1A1TDP1HSD17B10MAPTLMNA | |
| Piperonal SCHEMBL4204261 | 0.81 | ALDH1A1 (0.79) | ALDH1A1TDP1HSD17B10MAPTMEN1 | |
| Piperonal SCHEMBL28534378 | 0.81 | ALDH1A1 (0.85) | ALDH1A1TDP1HSD17B10CYP19A1MAPT |
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-101151530-A | Technique for detecting microorganisms | KIMBERLY CLARK CO (US) | 2008-03-26 | — | — | CN | disclosed |
| EP-1864128-A1 | TECHNIQUE FOR DETECTING MICROORGANISMS | Kimberly-Clark Worldwide, Inc. (US) | 2007-12-12 | — | — | EP | disclosed |
| WO-2006107370-A1 | TECHNIQUE FOR DETECTING MICROORGANISMS | KIMBERLY-CLARK WORLDWIDE, INC. (US) | 2006-10-12 | — | — | WO | disclosed |