Known targets — ChEMBL curated mechanism
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
The experimentally established mechanism targets of Allylbenzene. 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 | |
|---|---|---|---|---|
| ▸ | MAOB known ✓ | P27338 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.44 |
| ▸ | CYP2C8 | P10632 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | XDH | P47989 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Allylbenzene SCHEMBL11301260 | 0.98 | CNR2 (0.50) | CNR2MAOBCYP3A4ALDH1A1KDM4E | |
| Allylbenzene SCHEMBL44762 | 0.98 | CNR2 (0.50) | CNR2MAOBCYP3A4ALDH1A1KDM4E | |
| Allylbenzene SCHEMBL18040305 | 0.96 | CNR2 (0.49) | CNR2MAOBCYP3A4ALDH1A1KDM4E | |
| Allylbenzene SCHEMBL18040306 | 0.96 | CNR2 (0.49) | CNR2MAOBCYP3A4ALDH1A1KDM4E | |
| Allylbenzene SCHEMBL28108484 | 0.90 | CNR2 (0.46) | CNR2MAOBCYP3A4ALDH1A1KDM4E | |
| Allylbenzene SCHEMBL27290284 | 0.90 | CNR2 (0.51) | CNR2MAOBCYP3A4ALDH1A1KDM4E | |
| Allylbenzene SCHEMBL27481287 | 0.87 | MAOB (0.48) | CNR2MAOBCYP3A4ALDH1A1CYP2C19 | |
| Allylbenzene SCHEMBL249313 | 0.87 | MAOB (0.57) | CNR2MAOBCYP3A4ALDH1A1KDM4E | |
| Allylbenzene SCHEMBL318129 | 0.87 | MAOB (0.57) | CNR2MAOBCYP3A4ALDH1A1KDM4E | |
| Allylbenzene SCHEMBL27636637 | 0.87 | MAOB (0.57) | CNR2MAOBCYP3A4ALDH1A1KDM4E |
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 90 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116730769-A | Ammonium chloride anti-caking agent | 安徽天膜科技有限公司 | 2023-09-12 | — | — | CN | claimed |
| CN-114149871-A | Biological environment-friendly oil stain cleaning agent with fire extinguishing function and preparation method and application thereof | 南京军科超材科技有限公司 | 2022-03-08 | — | — | CN | claimed |
| US-11046922-B1 | 2-in-1 unit dose providing softening and detergency | Henkel IP & Holding GmbH (DE) | 2021-06-29 | — | — | US | claimed |
| US-20210179982-A1 | 2-in-1 Unit Dose Providing Softening And Detergency | Henkel IP & Holding GmbH (DE) | 2021-06-17 | — | — | US | claimed |
| CN-112608718-A | Anti-slip agent | 郑州聚砼汇实业有限公司 | 2021-04-06 | — | — | CN | claimed |
| US-10806143-B2 | Herbicidal composition in granular form | FMC CORPORATION (US) | 2020-10-20 | — | — | US | claimed |
| CN-111100227-A | Propylene polymerization method and device | 中国石油化工股份有限公司 | 2020-05-05 | — | — | CN | claimed |
| CN-108203579-B | Nitrogen foam gel plugging agent and preparation method and application thereof | 中国石油天然气股份有限公司 | 2020-03-10 | — | — | CN | claimed |
| CN-1243075-C | Negative pressure well fluid for oil well repairing operation and its prepn | UNIV SHANDONG (CN) | 2006-02-22 | — | — | CN | claimed |
| EP-1241649-B1 | Composition for use in the testing of smoke detectors | NO CLIMB PRODUCTS LTD (GB) | 2005-05-11 | — | — | EP | claimed |
| CN-1526788-A | Negative pressure well fluid for oil well repairing operation and its prepn | 山东师范大学 | 2004-09-08 | — | — | CN | claimed |
| CN-1480517-A | Carbon remover without need of disassembling engine | 吴燕琳 | 2004-03-10 | — | — | CN | claimed |
| EP-1241649-A2 | Composition for use in the testing of smoke detectors | No Climb Products Limited (GB) | 2002-09-18 | — | — | EP | claimed |
| EP-0530708-B1 | Liquid laundry detergent compositions | ALBRIGHT & WILSON UK LTD (GB) | 1997-01-22 | — | — | EP | claimed |
| EP-3544581-B1 | AQUEOUS COSMETIC | LVMH RECH (FR) | 2023-11-08 | — | — | EP | disclosed |
| US-20230338266-A1 | AQUEOUS COSMETIC | LVMH RECH (FR) | 2023-10-26 | — | — | US | disclosed |
| CN-116730769-A | Ammonium chloride anti-caking agent | 安徽天膜科技有限公司 | 2023-09-12 | — | — | CN | disclosed |
| US-5053159-A | phenoxy ethanol as antibacterial agent | COLGATE-PALMOLIVE COMPANY (US) | 1991-10-01 | — | — | US | disclosed |
| US-4729940-A | Method of manufacturing master for optical information carrier | CBS INC. (US) | 1988-03-08 | — | — | US | disclosed |
| US-3935868-A | Hair setting process | THE PROCTER & GAMBLE COMPANY (US) | 1976-02-03 | — | — | US | disclosed |