Choline

Choline

SCHEMBL2733734

C[N+](C)(C)CCO.C[N+](C)(C)CCO.O=P([O-])([O-])OCC(O)CO

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

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.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 known ✓ P0DMS8 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.65
LMNA P02545 5/20 0.39
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
CYP3A4 P08684 3/20 0.39
SLC5A7 Q9GZV3 1/20 0.39
AKT1 P31749 2/20 0.32
ESR1 P03372 1/20 0.32
CDC25A P30304 1/20 0.32
AGTR1 P30556 1/20 0.32
ADRA1A P35348 1/20 0.32
KCNH2 Q12809 1/20 0.32
S1PR1 P21453 1/20 0.31
MAPK1 P28482 5/20 0.31
GMNN O75496 3/20 0.31
BLM P54132 3/20 0.31
NPSR1 Q6W5P4 3/20 0.31
PRKD3 O94806 1/20 0.31
PRKCG P05129 1/20 0.31

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.

Compoundsimilaritytop predictedshared targets
Choline SCHEMBL6017026 0.89 SMN1; SMN2 (0.63) SMN1; SMN2LMNAMEN1KMT2ACYP3A4
Choline SCHEMBL29876695 0.85 SMN1; SMN2 (0.58) SMN1; SMN2LMNAMEN1KMT2ACYP3A4
Choline SCHEMBL1009005 0.85 SMN1; SMN2 (0.58) SMN1; SMN2LMNAMEN1KMT2ACYP3A4
SCHEMBL4450401 0.84 SMN1; SMN2 (0.53) SMN1; SMN2LMNAMEN1KMT2AALDH1A1
SCHEMBL124155 0.84 SMN1; SMN2 (0.53) SMN1; SMN2LMNAMEN1KMT2AALDH1A1
SCHEMBL16567918 0.84 SMN1; SMN2 (0.53) SMN1; SMN2LMNAMEN1KMT2AALDH1A1
(2E)-Hexenoic Acid SCHEMBL29002245 0.83 SMN1; SMN2 (0.48) SMN1; SMN2MEN1KMT2AS1PR1ALDH1A1
Choline SCHEMBL4889640 0.82 SMN1; SMN2 (0.63) SMN1; SMN2LMNAMEN1KMT2ACYP3A4
Choline SCHEMBL16618494 0.82 SMN1; SMN2 (0.53) SMN1; SMN2LMNAMEN1KMT2ACYP3A4
Choline SCHEMBL29033638 0.82 SMN1; SMN2 (0.53) SMN1; SMN2LMNAMEN1KMT2ACYP3A4

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 165 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3869192-B1 METHOD FOR QUANTITATIVE DETECTION OF VARIOUS METABOLITES IN BIOLOGICAL SAMPLE HUMAN METABOLOMICS INST INC (CN) 2026-05-13 EP claimed
US-20250258146-A1 QUANTITATIVE DETECTION METHOD OF MULTIPLE METABOLITES IN BIOLOGICAL SAMPLE AND METABOLIC CHIP HUMAN METABOLOMICS INSTITUTE INC. (CN) 2025-08-14 US claimed
CN-117585944-A Novel swing piece of sapphire material 北京星箭传感器科技有限公司 2024-02-23 CN claimed
US-20230263736-A1 SOFT GELATIN CAPSULES ITF RESEARCH PHARMA, S.L.U (ES) 2023-08-24 US claimed
EP-4171519-A1 SOFT GELATIN CAPSULES ITF Research Pharma, S.L.U. (ES) 2023-05-03 EP claimed
WO-2023007088-A1 FOOD SUPPLEMENT FOR COMBATING FEMALE AND MALE INFERTILITY NURIBIOL (FR) 2023-02-02 WO claimed
CN-114558061-A Loquat leaf extract and preparation method and application thereof 浙江大学 2022-05-31 CN claimed
US-20220026398-A1 QUANTITATIVE DETECTION METHOD OF MULTIPLE METABOLITES IN BIOLOGICAL SAMPLE AND METABOLIC CHIP HUMAN METABOLOMICS INSTITUTE INC. (CN) 2022-01-27 US claimed
WO-2021260093-A1 SOFT GELATIN CAPSULES ITF RESEARCH PHARMA, S.L.U (ES) 2021-12-30 WO claimed
CN-109709220-B Combined marker for diagnosing bladder cancer, kit and application 中国科学院大连化学物理研究所 2021-09-17 CN claimed
EP-3400267-A1 TUNGSTEN PROCESSING SLURRY WITH CATALYST Cabot Microelectronics Corporation (US) 2018-11-14 EP claimed
CN-105126179-B Sustained-release drug carrier composition 波利皮得有限公司 2018-09-25 CN claimed
US-10066126-B2 Tungsten processing slurry with catalyst CABOT MICROELECTRONICS CORPORATION (US) 2018-09-04 US claimed
CN-103260702-B Sustained release formulations of non-steroidal anti-inflammatory drugs 帕西拉制药有限公司 2018-07-27 CN claimed
CN-108271360-A Lipophilic cationic dendritic polymer and use thereof 得克萨斯州大学系统董事会 2018-07-10 CN claimed
CN-104971672-B Method for preparing major diameter synthesis membrane vesicle 帕西拉制药有限公司 2018-01-02 CN claimed
CN-107261110-A The novel formulation of the liposomal encapsulated glycopeptide antibiotic of PEGylation 健康科学西部大学 2017-10-20 CN claimed
CN-104959087-B For preparing the method that major diameter synthesizes membrane vesicle 帕西拉制药有限公司 2017-08-15 CN claimed
WO-2017120402-A1 TUNGSTEN PROCESSING SLURRY WITH CATALYST CABOT MICROELECTRONICS CORPORATION (US) 2017-07-13 WO claimed
US-20170190936-A1 TUNGSTEN PROCESSING SLURRY WITH CATALYST CMC MATERIALS LLC 2017-07-06 US claimed