Glycinebetaine

Glycinebetaine

SCHEMBL8747327

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nearest known ligand 0.46

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 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.46
APEX1 P27695 2/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
CTH P32929 1/20 0.34
BBOX1 O75936 1/20 0.33
SLC22A16 Q86VW1 1/20 0.33
CRAT P43155 1/20 0.32
CPT2 P23786 1/20 0.31
CPT1A P50416 1/20 0.31
CA4 P22748 1/20 0.31

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 SCHEMBL8858999 1.00 TSHR (0.46) TSHRAPEX1ALDH1A1LMNACTH
Glycinebetaine SCHEMBL4541516 0.93 TSHR (0.40) TSHRAPEX1ALDH1A1LMNACTH
Glycinebetaine SCHEMBL156936 0.82 TSHR (0.46) TSHRAPEX1ALDH1A1LMNABBOX1
Glycinebetaine SCHEMBL9281697 0.79 TSHR (0.55) TSHRAPEX1ALDH1A1LMNABBOX1
Glycinebetaine SCHEMBL8678519 0.79 TSHR (0.53) TSHRAPEX1ALDH1A1LMNABBOX1
Glycinebetaine SCHEMBL2803780 0.79 TSHR (0.53) TSHRAPEX1ALDH1A1LMNABBOX1
Betaine SCHEMBL31467313 0.79
Glycinebetaine SCHEMBL4900209 0.79
Glycinebetaine SCHEMBL7739 0.79
Sarcosine SCHEMBL31612550 0.79

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-0760402-A1 Carbon dioxide steel corrosion inhibition with synergetic, environmental friendly composition of N-acyl sarcosines and N-alkyl-amidopropylbetaines CECA S.A. (FR) 1997-03-05 EP disclosed