Glycinebetaine

Glycinebetaine

SCHEMBL1646002

C[N+](C)(C)CC(=O)[O-].NC(CCS)C(=O)O

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

BHMTBHMT2

The experimentally established mechanism targets of Glycinebetaine. 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
PTGS1 P23219 1/20 0.41
SLC7A11 Q9UPY5 1/20 0.41
GSR P00390 2/20 0.38
GRM8 O00222 1/20 0.38
GRM6 O15303 1/20 0.38
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
CYP1A2 P05177 1/20 0.38
GRIK1 P39086 1/20 0.38
GRM5 P41594 1/20 0.38
GRIA1 P42261 1/20 0.38
GRIA2 P42262 1/20 0.38
GRIA3 P42263 1/20 0.38
SLC1A3 P43003 1/20 0.38
SLC1A2 P43004 1/20 0.38
SLC1A1 P43005 1/20 0.38
GRIA4 P48058 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIK2 Q13002 1/20 0.38

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
Glycinebetaine SCHEMBL1646004 1.00 PTGS1 (0.41) PTGS1SLC7A11GSRGRM8GRM6
Methionine SCHEMBL5484912 0.90 RNPEP (0.39) PTGS1SLC7A11ANPEPENPEP
Glycinebetaine SCHEMBL18107967 0.86 PTGS1 (0.59) PTGS1SLC7A11GSRGRM8GRM6
Norvaline SCHEMBL20476465 0.84 SLC1A2 (0.46) GSRGRM8GRM6GRIN2DGRIN3B
Glycinebetaine SCHEMBL272555 0.84 GSR (0.39) GSRGRM8GRM6GRIN2DGRIN3B
Glutamic Acid SCHEMBL2504670 0.83 GRM8 (0.62) GSRGRM8GRM6GRIN2DGRIN3B
D-Glutamate SCHEMBL272113 0.83 GRM8 (0.62) GSRGRM8GRM6GRIN2DGRIN3B
Glutamic Acid SCHEMBL8995461 0.81 GRM8 (0.60) GSRGRM8GRM6GRIN2DGRIN3B
Ornithine Aketoglutarate SCHEMBL272917 0.81 GSR (0.56) GSRCYP1A2CPT2CPT1ABLM
Ornithine SCHEMBL1539161 0.81 GSR (0.56) GSRCYP1A2CPT2CPT1ABLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1249225-C Preparation and application of recombined human betaine homocysteine methyl transferase INST OF HYGIENICS AND ENVIRONM (CN) 2006-04-05 CN claimed
US-20220229077-A1 DIAGNOSIS, PROGNOSIS AND TREATMENT FOR SCHIZOPHRENIA AND SCHIZOAFFECTIVE PSYCHOSIS PRECISION MEDICINE HOLDINGS PTY LTD (AU) 2022-07-21 US disclosed
EP-2773355-B1 METHODS, FORMULATIONS, AND KITS FOR RAPIDLY REPLETING FOLATE LEVELS IN WOMEN SOUTH ALABAMA MEDICAL SCIENCE FOUND (US) 2022-06-08 EP disclosed
US-20210346319-A1 Pharmaceutical Compositions of R-(+)-Propranolol in Enantiomeric Excess and Therapeutic Uses Related Thereto NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-11-11 US disclosed
WO-2020072311-A1 PHARMACEUTICAL COMPOSITIONS OF R-(+)-PROPRANOLOL IN ENANTIOMERIC EXCESS AND THERAPEUTIC USES RELATED THERETO EMORY UNIVERSITY (US) 2020-04-09 WO disclosed
EP-2309876-B1 NUTRITIONAL COMPOSITION CONTAINING OLIGOSACCHARIDE MIXTURE NESTLE SA (CH) 2020-03-25 EP disclosed
EP-3612214-A1 OPTIMIZATION OF ENZYME REPLACEMENT THERAPY FOR TREATMENT OF HOMOCYSTINURIA The Regents Of The University Of Colorado, A Body Corporate, A Colorado Non-Profit (US) 2020-02-26 EP disclosed
US-20200049722-A1 DIAGNOSIS, PROGNOSIS AND TREATMENT FOR SCHIZOPHRENIA AND SCHIZOAFFECTIVE PSYCHOSIS PRECISION MEDICINE HOLDINGS PTY LTD (AU) 2020-02-13 US disclosed
EP-3516389-A1 DIAGNOSIS, PROGNOSIS AND TREATMENT FOR SCHIZOPHRENIA AND SCHIZOAFFECTIVE PSYCHOSIS Precision Medicine Holdings Pty Ltd (AU) 2019-07-31 EP disclosed
US-10357496-B2 Methods, formulations, and kits for rapidly repleting folate levels in women SOUTH ALABAMA MEDICAL SCIENCE FOUNDATION (US) 2019-07-23 US disclosed
CN-1807634-A Corynebacterium glutamicum genes encoding proteins involved in carbon metabolism and energy production BASF AG (DE) 2006-07-26 CN disclosed
US-7060444-B1 Zone 3 necrosis associated markers and method of use thereof CURAGEN CORPORATION (US) 2006-06-13 US disclosed
CN-1249225-C Preparation and application of recombined human betaine homocysteine methyl transferase INST OF HYGIENICS AND ENVIRONM (CN) 2006-04-05 CN disclosed
CN-1249225-C Preparation and application of recombined human betaine homocysteine methyl transferase INST OF HYGIENICS AND ENVIRONM (CN) 2006-04-05 CN disclosed
CN-1249225-C Preparation and application of recombined human betaine homocysteine methyl transferase INST OF HYGIENICS AND ENVIRONM (CN) 2006-04-05 CN disclosed
WO-2005058300-A1 METHOD OF TREATING ELEVATED PLASMA HOMOCYSTEINE LEVELS IN ESRD PATIENTS LONDON HEALTH SCIENCES CENTRE RESEARCH INC. (CA) 2005-06-30 WO disclosed
CN-1408854-A Preparation and application of recombinant human betaine homocysteine methyltransferase INST OF HYGIENICS AND ENVIRONM (CN) 2003-04-09 CN disclosed
CN-1408854-A Preparation and application of recombinant human betaine homocysteine methyltransferase INST OF HYGIENICS AND ENVIRONM (CN) 2003-04-09 CN disclosed
WO-2001002600-A2 DETECTION OF ANALYTES USING ATTENUATED ENZYMES GENERAL ATOMICS (US) 2001-01-11 WO disclosed
US-5428063-A For treating or preventing fatty infiltration, the first stage of cirrhosis BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 1995-06-27 US disclosed