Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Vanillin. 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 | 5/20 | 0.76 |
| ▸ | HPGD | P15428 | 2/20 | 0.76 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.76 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.76 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.76 |
| ▸ | ABAT | P80404 | 1/20 | 0.76 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.76 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.57 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.57 |
| ▸ | XDH | P47989 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 4/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | TYR | P14679 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.52 |
| ▸ | HSD11B1 | P28845 | 2/20 | 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 | |
|---|---|---|---|---|
| Vanillin SCHEMBL25193907 | 0.94 | ALDH1A1 (0.68) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 | |
| Vanillin SCHEMBL18497680 | 0.92 | ALDH1A1 (0.78) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 | |
| Vanillin SCHEMBL21134387 | 0.91 | ALDH1A1 (0.76) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 | |
| Vanillin SCHEMBL4665586 | 0.91 | ALDH1A1 (0.62) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 | |
| Vanillin SCHEMBL432750 | 0.91 | ALDH1A1 (0.62) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 | |
| Vanillin SCHEMBL118411 | 0.91 | ALDH1A1 (0.62) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 | |
| Vanillin SCHEMBL44060 | 0.87 | ALDH1A1 (0.86) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 | |
| Vanillin SCHEMBL29354839 | 0.87 | ALDH1A1 (1.00) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 | |
| Vanillin SCHEMBL1213 | 0.87 | ALDH1A1 (1.00) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 | |
| Vanillin SCHEMBL720723 | 0.87 | ALDH1A1 (1.00) | ALDH1A1HPGDTDP1TRIM24ALDH5A1 |
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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101238203-B | Flavor and fragrance composition | TAKASAGO PERFUMERY CO LTD | 2011-08-17 | — | — | CN | claimed |
| CN-101238203-A | Flavor and fragrance composition | TAKASAGO PERFUMERY CO LTD (JP) | 2008-08-06 | — | — | CN | claimed |
| WO-2007092811-A2 | SIALAGOGUE BASED ORAL CARE PRODUCTS | WHITEHILL ORAL TECHNOLOGIES, INC. (US) | 2007-08-16 | — | — | WO | claimed |
| US-20240065285-A1 | CHOCOLATE REPLICAS PRODUCED FROM INDIVIDUAL COMPONENTS | Voyage Foods, Inc. | 2024-02-29 | — | — | US | disclosed |
| WO-2024042191-A1 | ORAL CARE COMPOSITIONS | BLISSANDMORE GMBH (DE) | 2024-02-29 | — | — | WO | disclosed |
| US-20240049741-A1 | CHOCOLATE REPLICAS PRODUCED FROM INDIVIDUAL COMPONENTS | Voyage Foods, Inc. | 2024-02-15 | — | — | US | disclosed |
| US-11832632-B2 | Chocolate replicas produced from individual components | Voyage Foods, Inc. (US) | 2023-12-05 | — | — | US | disclosed |
| US-20230033131-A1 | CHOCOLATE REPLICAS PRODUCED FROM INDIVIDUAL COMPONENTS | Voyage Foods, Inc. | 2023-02-02 | — | — | US | disclosed |
| CN-217368309-U | Vanillin propylene glycol acetal is with negative pressure condensation device | 安徽锦戎香料有限公司 | 2022-09-06 | — | — | CN | disclosed |
| CN-108047188-B | Production method of vanillin-1, 2-propanediol acetal | 重庆欣欣向荣精细化工有限公司 | 2020-05-08 | — | — | CN | disclosed |
| CN-109069361-A | Oral care composition comprising gel network phase and potassium nitrate | 宝洁公司 | 2018-12-21 | — | — | CN | disclosed |
| US-20160331659-A1 | Methods And Compositions For Modifying Sensorial Perception | PROCTER & GAMBLE (US) | 2016-11-17 | — | — | US | disclosed |
| US-9427415-B2 | Methods and compositions for modifying sensorial perception | THE PROCTER & GAMBLE COMPANY (US) | 2016-08-30 | — | — | US | disclosed |
| EP-2983668-A1 | COMPOSITIONS TO ALLEVIATE PRESYSTEMIC METABOLISM OF OPIOIDS | Virginia Commonwealth University (US) | 2016-02-17 | — | — | EP | disclosed |
| WO-2014168925-A1 | COMPOSITIONS TO ALLEVIATE PRESYSTEMIC METABOLISM OF OPIOIDS | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 2014-10-16 | — | — | WO | disclosed |
| CN-101238203-B | Flavor and fragrance composition | TAKASAGO PERFUMERY CO LTD | 2011-08-17 | — | — | CN | disclosed |
| CN-101238203-A | Flavor and fragrance composition | TAKASAGO PERFUMERY CO LTD (JP) | 2008-08-06 | — | — | CN | disclosed |
| CN-100400533-C | Valerolactone compounds and perfume compositions | KAO CORP (JP) | 2008-07-09 | — | — | CN | disclosed |
| CN-1233276-A | Rinse added fabric softening composition and method for delivery of pro-fragrances | PROCTER & GAMBLE (US) | 1999-10-27 | — | — | CN | disclosed |
| CN-1233283-A | Rinse added fabric softening compositions and methods for delivering perfume derivatives | PROCTER & GAMBLE (US) | 1999-10-27 | — | — | CN | disclosed |