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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 13/20 | 0.41 |
| ▸ | PPARA | Q07869 | 11/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | PPARD | Q03181 | 4/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7033474 | 0.86 | PPARA (0.47) | PPARGPPARAMAPTCYP2C19MEN1 | |
| Choline SCHEMBL7022303 | 0.82 | PPARA (0.43) | PPARGPPARACHRM2CHRM1CHRM3 | |
| Potassium Ion SCHEMBL11787600 | 0.82 | PPARA (0.47) | PPARGPPARAMAPTCYP2C19MEN1 | |
| Levocarnitine SCHEMBL7031665 | 0.72 | SLC22A16 (0.53) | PPARGPPARAMAPTCYP2C19MEN1 | |
| Glycinebetaine SCHEMBL3441165 | 0.72 | CA12 (0.44) | CHRM2CHRM1CHRM3CYP2C19MEN1 | |
| Glycinebetaine SCHEMBL7022976 | 0.71 | LMNA (0.45) | PPARGPPARACYP2C19CYP3A4CYP2D6 | |
| Glycinebetaine SCHEMBL9710566 | 0.70 | MTNR1A (0.39) | CHRM2CHRM1CHRM3CYP2C19MEN1 | |
| SCHEMBL247466 | 0.69 | PPARA (0.68) | PPARGPPARAMAPTCYP2C19MEN1 | |
| SCHEMBL27597867 | 0.69 | PPARA (0.41) | PPARGPPARAMAPTCYP2C19MEN1 | |
| Clofibric Acid SCHEMBL11639907 | 0.69 | PPARA (0.68) | PPARGPPARAMAPTCYP2C19MEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0997453-B1 | Phenoxyisobutyric acid ammonium salts and pharmaceutical formulations containing them | FATRO SPA (IT) | 2003-02-05 | — | — | EP | claimed |
| EP-0997453-A1 | Phenoxyisobutyric acid ammonium salts and pharmaceutical formulations containing them | FATRO S.p.A. (IT) | 2000-05-03 | — | — | EP | claimed |
| EP-0997453-B1 | Phenoxyisobutyric acid ammonium salts and pharmaceutical formulations containing them | FATRO SPA (IT) | 2003-02-05 | — | — | EP | disclosed |
| EP-0997453-A1 | Phenoxyisobutyric acid ammonium salts and pharmaceutical formulations containing them | FATRO S.p.A. (IT) | 2000-05-03 | — | — | EP | disclosed |