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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL4292047 | 0.86 | CPB2 (0.33) | — | |
| SCHEMBL4292046 | 0.86 | CPB2 (0.33) | — | |
| Histidine SCHEMBL6701803 | 0.83 | SLC7A5 (0.38) | — | |
| SCHEMBL151334 | 0.75 | CPB2 (0.36) | — | |
| SCHEMBL27547178 | 0.75 | CPB2 (0.36) | — | |
| SCHEMBL151335 | 0.75 | CPB2 (0.36) | — | |
| SCHEMBL163396 | 0.75 | CPB2 (0.36) | — | |
| Hydrochloric Acid SCHEMBL11623237 | 0.74 | CPB2 (0.35) | — | |
| Hydrochloric Acid SCHEMBL11744084 | 0.74 | CPB2 (0.35) | — | |
| SCHEMBL7074055 | 0.74 | CPB2 (0.40) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0806897-A4 | OSMOLYTE REGULATOR | TALL HOLDINGS PTY LTD AB (AU) | 1999-06-16 | — | — | EP | claimed |
| EP-0806897-A1 | OSMOLYTE REGULATOR | A.B. TALL (HOLDINGS) PTY LTD. (AU) | 1997-11-19 | — | — | EP | claimed |
| WO-1996023413-A1 | OSMOLYTE REGULATOR | AB TALL (HOLDINGS) PTY. LTD. (AU) | 1996-08-08 | — | — | WO | claimed |
| WO-2024140866-A1 | USE OF L-ERGOTHIONEINE IN PREPARATION OF PRODUCT FOR PREVENTING OR INHIBITING CELL DAMAGE CAUSED BY ACETALDEHYDE | 华熙生物科技股份有限公司 | 2024-07-04 | — | — | WO | disclosed |
| CN-117959195-A | Glabridin-based composition for inhibiting ergothioneine photodegradation | 上海家化联合股份有限公司 | 2024-05-03 | — | — | CN | disclosed |
| CN-116459246-A | Application of ergothioneine in preparation of product for preventing or inhibiting cell injury caused by acetaldehyde | 华熙生物科技股份有限公司 | 2023-07-21 | — | — | CN | disclosed |
| CN-112980760-A | Genetic engineering strain for producing ergothioneine and construction method and application thereof | 华东理工大学 | 2021-06-18 | — | — | CN | disclosed |