Known targets — ChEMBL curated mechanism
ADORA1ADORA2AADORA2BADORA3GNRHRMPLPDE3APDE3BPDE4APDE4BPDE4CPDE4DPPARASLC5A2
The experimentally established mechanism targets of Choline. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| Choline SCHEMBL28133468 | 1.00 | — | — | |
| Choline SCHEMBL30145313 | 1.00 | — | — | |
| Choline SCHEMBL28083629 | 0.96 | — | — | |
| Choline SCHEMBL27966594 | 0.96 | — | — | |
| Choline SCHEMBL27966620 | 0.96 | — | — | |
| Choline SCHEMBL27998285 | 0.96 | — | — | |
| Choline SCHEMBL28225819 | 0.96 | — | — | |
| Choline SCHEMBL28225937 | 0.96 | — | — | |
| Choline SCHEMBL8012313 | 0.96 | MEN1 (0.92) | — | |
| Choline SCHEMBL29394392 | 0.96 | — | — |
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 94 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3694931-B1 | SURFACE COATING | UNIV COURT UNIV OF EDINBURGH (GB) | 2022-12-21 | — | — | EP | claimed |
| CN-109575144-A | A kind of sulfonated microcrystalline cellulose stabilizer of quaternary ammonium-and its application in cell member herbicide | 黄美红 | 2019-04-05 | — | — | CN | claimed |
| CN-108641679-A | A kind of special dust suppressant of Railway Coal transport | 薛向东 | 2018-10-12 | — | — | CN | claimed |
| CN-108542879-A | A kind of injection Citicolini pharmaceutical composition and its preparation method and application | 吉林百年汉克制药有限公司 | 2018-09-18 | — | — | CN | claimed |
| CN-104277071-B | A kind of glyphosate choline raw drug, preparation and preparation method thereof | 山东潍坊润丰化工股份有限公司 | 2017-03-08 | — | — | CN | claimed |
| US-8414862-B2 | Preparation of CZTS and its analogs in ionic liquids | E I DU PONT DE NEMOURS AND COMPANY (US) | 2013-04-09 | — | — | US | claimed |
| US-20130061612-A1 | REFRIGERANT STORAGE IN SECONDARY LOOP REFRIGERATION SYSTEMS | E.I. DU PONT DE NEMOURS AND COMPANY (DE) | 2013-03-14 | — | — | US | claimed |
| EP-2499212-A2 | REFRIGERANT STORAGE IN SECONDARY LOOP REFRIGERATION SYSTEMS | E. I. du Pont de Nemours and Company (US) | 2012-09-19 | — | — | EP | claimed |
| US-20120201742-A1 | PREPARATION OF CZTS AND ITS ANALOGS IN IONIC LIQUIDS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2012-08-09 | — | — | US | claimed |
| EP-2414476-A1 | IONIC COMPOUNDS IN LITHIUM BROMIDE/WATER ABSORPTION CYCLE SYSTEMS | E. I. du Pont de Nemours and Company (US) | 2012-02-08 | — | — | EP | claimed |
| US-20120027661-A1 | PROCESS AND REACTOR SYSTEM FOR PRODUCING AMMONIA USING IONIC LIQUIDS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2012-02-02 | — | — | US | claimed |
| US-20110203301-A1 | ABSORPTION CYCLE UTILIZING IONIC COMPOUNDS AND/OR NON-IONIC ABSORBENTS AS WORKING FLUIDS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2011-08-25 | — | — | US | claimed |
| EP-2344606-A2 | ABSORPTION CYCLE UTILIZING IONIC COMPOUNDS AND/OR NON-IONIC ABSORBENTS AS WORKING FLUIDS | E. I. du Pont de Nemours and Company (US) | 2011-07-20 | — | — | EP | claimed |
| WO-2011066273-A1 | PREPARATION OF CZTS AND ITS ANALOGS IN IONIC LIQUIDS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2011-06-03 | — | — | WO | claimed |
| WO-2011060067-A2 | REFRIGERANT STORAGE IN SECONDARY LOOP REFRIGERATION SYSTEMS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2011-05-19 | — | — | WO | claimed |
| WO-2010117836-A1 | IONIC COMPOUNDS IN LITHIUM BROMIDE/WATER ABSORPTION CYCLE SYSTEMS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2010-10-14 | — | — | WO | claimed |
| WO-2010054230-A2 | ABSORPTION CYCLE UTILIZING IONIC COMPOUNDS AND/OR NON-IONIC ABSORBENTS AS WORKING FLUIDS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2010-05-14 | — | — | WO | claimed |
| US-4594193-A | Containing liposome forming group; vesicles | RESEARCH CORPORATION (US) | 1986-06-10 | — | — | US | claimed |
| US-12606511-B2 | Processes for the acylation of an aromatic compound | UNIVERSITY OF KANSAS (US) | 2026-04-21 | — | — | US | disclosed |
| US-4594193-A | Containing liposome forming group; vesicles | RESEARCH CORPORATION (US) | 1986-06-10 | — | — | US | disclosed |