Known targets — ChEMBL curated mechanism
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)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | 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.
| Compound | similarity | top predicted | shared 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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |