Choline

Choline

SCHEMBL3304484

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

nearest known ligand 0.68

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 0.68
SLC5A7 Q9GZV3 1/20 0.68
LMNA P02545 4/20 0.60
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
ALDH1A1 P00352 1/20 0.47
THRB P10828 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
PSMD14 O00487 2/20 0.38
PLA2G1B P04054 2/20 0.38
MMP2 P08253 2/20 0.38
ATG4B Q9Y4P1 2/20 0.38
RAD52 P43351 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
APEX1 P27695 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
SLC22A16 Q86VW1 1/20 0.34
MAPT P10636 1/20 0.34
HSP90AA1 P07900 1/20 0.34
NFKB1 P19838 2/20 0.30

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 SCHEMBL22418373 0.97 CYP3A4 (0.65) CYP3A4SLC5A7LMNAMEN1KMT2A
Choline SCHEMBL28247967 0.97 CYP3A4 (0.65) CYP3A4SLC5A7LMNAMEN1KMT2A
Choline SCHEMBL28214932 0.97 CYP3A4 (0.65) CYP3A4SLC5A7LMNAMEN1KMT2A
Choline SCHEMBL7169119 0.97 LMNA (0.63) CYP3A4SLC5A7LMNAMEN1KMT2A
Choline SCHEMBL28224033 0.95 LMNA (0.60) CYP3A4SLC5A7LMNAMEN1KMT2A
Choline SCHEMBL3309233 0.95 LMNA (0.60) CYP3A4SLC5A7LMNAMEN1KMT2A
Choline SCHEMBL4207428 0.95 LMNA (0.68) CYP3A4SLC5A7LMNAMEN1KMT2A
Choline SCHEMBL29002744 0.95 LMNA (0.60) CYP3A4SLC5A7LMNAMEN1KMT2A
Choline SCHEMBL28465207 0.93 CYP3A4 (0.59) CYP3A4SLC5A7LMNAMEN1KMT2A
Choline SCHEMBL28838083 0.89 CYP3A4 (0.54) CYP3A4SLC5A7LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118197817-A CNTs-MXenes composite material and preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2024-06-14 CN claimed
CN-118185362-A Water mist infrared stealth solution and preparation method thereof 江苏鸿源动力科技有限公司 2024-06-14 CN claimed
CN-118166055-A Crayfish shell ACE (angiotensin converting enzyme) inhibitory peptide and preparation method and application thereof 湖北工业大学 2024-06-11 CN claimed
CN-118126214-A Method for curing UV-LED by capsanthin/iodonium salt photoinitiation system 南京林业大学 2024-06-04 CN claimed
CN-118063815-A Preparation method and application of functional composite film containing lignin extract 中山大学附属第三医院 2024-05-24 CN claimed
CN-114164244-B Method for preparing hesperetin-7-O-glucoside and hesperetin 华南理工大学 2024-03-01 CN claimed
CN-117384303-A Preparation method of high-stability oxidized regenerated bean dreg cellulose nanocrystalline 中国农业科学院农产品加工研究所 2024-01-12 CN claimed
CN-117258767-A Novel psychoactive substance adsorbent and application thereof 西南政法大学 2023-12-22 CN claimed
CN-114411176-B Photoelectrocatalysis preparation H 2 O 2 Device and application thereof 太原师范学院 2023-10-27 CN claimed
CN-116904524-A Method for enzyme-catalyzed hydrolysis of ester substances by microfluidic three-liquid phase system 华南理工大学 2023-10-20 CN claimed
CN-108048421-A The method that transfructosylase catalytic efficiency and stability are improved using choline eutectic solvent 天津科技大学 2018-05-18 CN claimed
CN-104357526-B The method for preparing cholestenone using conversion of resting cells using eutectic as chaotropic agent 天津科技大学 2018-05-18 CN claimed
CN-107970157-A A kind of preparation method of the crease-resistant plant essence containing natural lemon acid 唐雪平 2018-05-01 CN claimed
CN-107898700-A A kind of preparation method of the anti-aging nanometer lip gloss containing vine polyphenol 唐雪平 2018-04-13 CN claimed
CN-107854366-A A kind of preparation method of natural fruit pigment used for cosmetic 林燕 2018-03-30 CN claimed
CN-107737096-A A kind of preparation method of pearl whitening additive used for cosmetic 林燕 2018-02-27 CN claimed
CN-107714629-A A kind of preparation method of the cosmetic pencil pen oil containing butter berry extract 林燕 2018-02-23 CN claimed
CN-107216718-A A kind of preparation method of temperature-control discoloring ink 厦门市诚安毅科技有限公司 2017-09-29 CN claimed
CN-106749805-A A kind of atom transfer radical polymerization method of utilization low temperature eutectic effect 华中科技大学 2017-05-31 CN claimed
CN-105861571-A Method for catalyzing asymmetric hydrolysis of 1,2-epoxyoctane by soybean epoxide hydrolase 华南理工大学 2016-08-17 CN claimed