Choline

Choline

SCHEMBL21800980

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

nearest known ligand 0.77

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
CYP3A4 P08684 1/20 0.77
SLC5A7 Q9GZV3 1/20 0.77
MEN1 O00255 1/20 0.67
LMNA P02545 1/20 0.67
KMT2A Q03164 1/20 0.67
CHRM5 P08912 3/20 0.42
CHRM1 P11229 3/20 0.42
CHRM3 P20309 3/20 0.42
BLM P54132 3/20 0.41
CHRM2 P08172 2/20 0.39
CHRM4 P08173 2/20 0.39
PGR P06401 1/20 0.39
HTR1A P08908 1/20 0.39
CHRNB2 P17787 1/20 0.39
TBXA2R P21731 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNA7 P36544 1/20 0.39
CHRNA4 P43681 1/20 0.39
SMN1; SMN2 Q16637 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.

Compoundsimilaritytop predictedshared targets
Choline SCHEMBL992915 0.97 MEN1 (0.71) CYP3A4SLC5A7MEN1LMNAKMT2A
Choline SCHEMBL29118960 0.94 MEN1 (0.77) CYP3A4SLC5A7MEN1LMNAKMT2A
Choline SCHEMBL4199945 0.89 CYP3A4 (0.68) CYP3A4SLC5A7MEN1LMNAKMT2A
Choline SCHEMBL2469440 0.88 MEN1 (0.67) CYP3A4SLC5A7MEN1LMNAKMT2A
Choline SCHEMBL1330530 0.87
Choline SCHEMBL2459999 0.87 CYP3A4 (1.00) CYP3A4SLC5A7MEN1LMNAKMT2A
Choline SCHEMBL1332010 0.87
Choline SCHEMBL14957 0.87
Choline SCHEMBL9391204 0.87 CYP3A4 (1.00) CYP3A4SLC5A7MEN1LMNAKMT2A
Choline SCHEMBL30612764 0.87

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114790253-B Acylated chitin and preparation method and application thereof 中科南京绿色制造产业创新研究院 2024-03-26 CN claimed
WO-2023170106-A1 AN ELECTROCHEMICAL PROCESS FOR RECOVERING PLATINUM GROUP METALS (PGMs) FROM SOLID RESIDUES FUNDACION TECNALIA RESEARCH & INNOVATION (ES) 2023-09-14 WO claimed
CN-116716751-A Method for extracting cotton stalk lignin by ultrasonic-assisted choline chloride-formic acid eutectic solvent 徐媛媛 2023-09-08 CN claimed
CN-109180617-B Two-phase biomass pretreatment co-production chemical method based on furfural compound extractant 中国科学院广州能源研究所 2020-12-04 CN claimed
CN-111154549-A Method for extracting rose essential oil from rose waste residue after extraction of essential oil 河北科技大学 2020-05-15 CN claimed
CN-118126159-A Green and efficient preparation method of swimming bladder collagen 中国农业大学 2024-06-04 CN disclosed
CN-118029185-A Method for preparing pricklyash seed cellulose by superfine grinding auxiliary eutectic solvent 农业农村部规划设计研究院 2024-05-14 CN disclosed
CN-114790253-B Acylated chitin and preparation method and application thereof 中科南京绿色制造产业创新研究院 2024-03-26 CN disclosed
US-11845909-B2 Method for the extraction of bio-oil from algal biomass ENI S.P.A. (IT) 2023-12-19 US disclosed
CN-117085658-A Amphetamine adsorbent and application thereof 西南政法大学 2023-11-21 CN disclosed
CN-115678036-B Method for extracting light-colored lignin based on ternary eutectic solvent 华南理工大学 2023-09-22 CN disclosed
CN-116751987-A Method for recycling anode material of waste lithium ion battery 北京车和家汽车科技有限公司 2023-09-15 CN disclosed
WO-2021036156-A1 EUTECTIC SOLVENT AND APPLICATION THEREOF IN EXTRACTING LIGNIN 齐鲁工业大学 2021-03-04 WO disclosed
CN-110540508-B Eutectic solvent and application thereof in extracting lignin 齐鲁工业大学 2021-01-01 CN disclosed
CN-109180617-B Two-phase biomass pretreatment co-production chemical method based on furfural compound extractant 中国科学院广州能源研究所 2020-12-04 CN disclosed
CN-111154549-A Method for extracting rose essential oil from rose waste residue after extraction of essential oil 河北科技大学 2020-05-15 CN disclosed
WO-2020053118-A1 METHOD FOR THE EXTRACTION OF BIO-OIL FROM ALGAL BIOMASS ENI S.P.A. (IT) 2020-03-19 WO disclosed
CN-110540508-A Eutectic solvent and application thereof in extracting lignin UNIV QILU TECHNOLOGY 2019-12-06 CN disclosed
CN-109180617-A A kind of two-phase biomass pretreatment coproduction chemical processes based on Furnan products extractant 中国科学院广州能源研究所 2019-01-11 CN disclosed
CN-102971451-B catalyst mixture 二氧化碳材料公司 2016-09-14 CN disclosed