Glycinebetaine

Glycinebetaine

SCHEMBL11008697

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

nearest known ligand 0.33

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 6)

geneUniProtsupporting neighboursconfidence
CPT2 P23786 1/20 0.33
CPT1A P50416 1/20 0.33
TSHR P16473 1/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
APEX1 P27695 1/20 0.32

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 SCHEMBL8772044 0.77 TSHR (0.55) CPT2CPT1ATSHRALDH1A1LMNA
Glycinebetaine SCHEMBL11579913 0.75 TSHR (0.52) CPT2CPT1ATSHRALDH1A1LMNA
Hydrochloric Acid SCHEMBL28511729 0.75
Glycinebetaine SCHEMBL9615832 0.73 TSHR (0.33) TSHRALDH1A1LMNAAPEX1
Glycinebetaine SCHEMBL2520108 0.73 LMNA (0.46) CPT2CPT1ATSHRALDH1A1LMNA
Glycinebetaine SCHEMBL10425194 0.71 TSHR (0.48) CPT2CPT1ATSHRALDH1A1LMNA
Glycinebetaine SCHEMBL8745870 0.71 TSHR (0.33) TSHR
Aspartic Acid SCHEMBL379368 0.69 CPT2 (0.44) CPT2CPT1ATSHRALDH1A1LMNA
Glycinebetaine SCHEMBL1617824 0.69 TSHR (0.42) CPT2CPT1ATSHRALDH1A1LMNA
Glycinebetaine SCHEMBL6051974 0.69 CPT2 (0.50) CPT2CPT1ATSHRALDH1A1LMNA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0143436-A2 Silver halide photographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 1985-06-05 EP disclosed