Choline

Choline

SCHEMBL1920353

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

nearest known ligand 0.55

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
LMNA P02545 2/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
CYP3A4 P08684 1/20 0.52
SLC5A7 Q9GZV3 1/20 0.52
GALR3 O60755 2/20 0.41
ACHE P22303 1/20 0.38
CHRM5 P08912 3/20 0.37
CHRM1 P11229 3/20 0.37
CHRM3 P20309 3/20 0.37
CHRM2 P08172 2/20 0.37
CHRM4 P08173 2/20 0.37
HTR1A P08908 2/20 0.37
CHRNB2 P17787 2/20 0.37
CHRNA7 P36544 2/20 0.37
CHRNA4 P43681 2/20 0.37
CYP2C19 P33261 2/20 0.37
PGR P06401 1/20 0.37
TBXA2R P21731 1/20 0.37
CHRNB4 P30926 1/20 0.37

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 SCHEMBL4154776 0.98 LMNA (0.50) LMNAMEN1KMT2ACYP3A4SLC5A7
Choline SCHEMBL3952326 0.98 CYP3A4 (0.56) LMNAMEN1KMT2ACYP3A4SLC5A7
Methacrylic Acid SCHEMBL8621490 0.87 ACHE (0.45) LMNAMEN1KMT2ACYP3A4SLC5A7
Choline SCHEMBL6706932 0.86 MEN1 (0.57) LMNAMEN1KMT2ACYP3A4SLC5A7
Choline SCHEMBL316506 0.85 LMNA (0.63) LMNAMEN1KMT2ACYP3A4SLC5A7
Choline SCHEMBL1052170 0.85 LMNA (0.63) LMNAMEN1KMT2ACYP3A4SLC5A7
Choline SCHEMBL31575663 0.85 LMNA (0.63) LMNAMEN1KMT2ACYP3A4SLC5A7
Methacrylic Acid SCHEMBL2231529 0.85 ACHE (0.43) LMNAMEN1KMT2ACYP3A4SLC5A7
Choline SCHEMBL29111296 0.84 LMNA (0.55) LMNAMEN1KMT2ACYP3A4SLC5A7
Choline SCHEMBL29809930 0.84 LMNA (0.55) LMNAMEN1KMT2ACYP3A4SLC5A7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3481878-B1 AMINE COMPOSITION USEFUL FOR MAKING POLYURETHANE FOAM EVONIK OPERATIONS GMBH (DE) 2024-05-22 EP claimed
US-11605508-B2 Bio-ionic liquid hydrogels and use of same ROWAN UNIVERSITY (US) 2023-03-14 US claimed
CN-109476803-B Amine compositions useful for making polyurethane foams 赢创运营有限公司 2022-04-12 CN claimed
US-11021561-B2 Amine composition useful for making polyurethane foam EVONIK OPERATIONS GMBH (DE) 2021-06-01 US claimed
US-20210151263-A1 BIO-IONIC LIQUID HYDROGELS AND USE OF SAME ROWAN UNIVERSITY 2021-05-20 US claimed
EP-3144332-B1 NEW TRIMER CATALYST ADDITIVES FOR IMPROVING FOAM PROCESSABILITY EVONIK OPERATIONS GMBH (DE) 2020-10-21 EP claimed
EP-3481878-A1 AMINE COMPOSITION USEFUL FOR MAKING POLYURETHANE FOAM Evonik Degussa GmbH (DE) 2019-05-15 EP claimed
US-20180237686-A1 METHOD FOR STIMULATION TREATMENT USING POLYMER-SURFACTANT COMBINATION HALLIBURTON ENERGY SERVICES, INC. (US) 2018-08-23 US claimed
WO-2018013590-A1 AMINE COMPOSITION USEFUL FOR MAKING POLYURETHANE FOAM EVONIK DEGUSSA GMBH (DE) 2018-01-18 WO claimed
US-20180009930-A1 AMINE COMPOSITION USEFUL FOR MAKING POLYURETHANE FOAM EVONIK OPERATIONS GMBH (DE) 2018-01-11 US claimed
WO-2009055306-A2 COATING DESIGNS FOR THE TAILORED RELEASE OF DUAL DRUGS FROM POLYMERIC COATINGS ABBOTT CARDIOVASCULAR SYSTEMS INC. (US) 2009-04-30 WO claimed
US-20090104247-A1 Coating Designs For The Tailored Release Of Dual Drugs From Polymeric Coatings ABBOTT CARDIOVASCULAR SYSTEMS INC. 2009-04-23 US claimed
WO-2008068467-A1 METHODS OF TREATING SUBTERRANEAN FORMATIONS USING HYDROPHOBICALLY MODIFIED POLYMERS AND COMPOSITIONS OF THE SAME HALLIBURTON ENERGY SERVICES, INC. (US) 2008-06-12 WO claimed
US-20080139411-A1 Methods of treating subterranean formations using hydrophobically modified polymers and compositions of the same HALLIBURTON ENERGY SERVICES, INC. 2008-06-12 US claimed
US-20070259773-A1 Trimer catalyst additives for improving foam processability EVONIK OPERATIONS GMBH (DE) 2007-11-08 US claimed
US-20070259982-A1 Trimer catalysts with improved processability and surface cure EVONIK OPERATIONS GMBH (DE) 2007-11-08 US claimed
EP-1852449-A2 New trimer catalyst with improved processability and surface cure Air Products and Chemicals, Inc. (US) 2007-11-07 EP claimed
EP-1852450-A2 New trimer catalyst additives for improving foam processability Air Products and Chemicals, Inc. (US) 2007-11-07 EP claimed
WO-2004094781-A1 METHODS OF TREATING SUBTERRANEAN FORMATIONS USING HYDROPHOBICALLY MODIFIED POLYMERS AND COMPOSITIONS OF THE SAME HALLIBURTON ENERGY SERVICES, INC. (US) 2004-11-04 WO claimed
US-20040209780-A1 Methods of treating subterranean formations using hydrophobically modified polymers and compositions of the same HALLIBURTON ENERGY SERVICES, INC. 2004-10-21 US claimed