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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 6/20 | 0.54 |
| ▸ | RAD52 | P43351 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | THRA | P10827 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CPT2 | P23786 | 1/20 | 0.38 |
| ▸ | CPT1A | P50416 | 1/20 | 0.38 |
| ▸ | CPT1B | Q92523 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 SCHEMBL1138405 | 1.00 | DNM1 (0.54) | DNM1RAD52NPSR1THRATHRB | |
| Dymanthine SCHEMBL1140094 | 1.00 | DNM1 (0.54) | DNM1RAD52NPSR1THRATHRB | |
| Glycinebetaine SCHEMBL3263276 | 0.95 | DNM1 (0.48) | DNM1RAD52NPSR1THRATHRB | |
| Glycinebetaine SCHEMBL3172571 | 0.95 | DNM1 (0.48) | DNM1RAD52NPSR1THRATHRB | |
| Glycinebetaine SCHEMBL3186147 | 0.95 | DNM1 (0.48) | DNM1RAD52NPSR1THRATHRB | |
| Dymanthine SCHEMBL16986517 | 0.84 | DNM1 (0.56) | DNM1RAD52NPSR1TSHRALDH1A1 | |
| Betaine SCHEMBL16986519 | 0.84 | DNM1 (0.56) | DNM1RAD52NPSR1TSHRALDH1A1 | |
| Glycinebetaine SCHEMBL15475728 | 0.83 | DNM1 (0.62) | DNM1RAD52NPSR1TSHRTP53 | |
| Glycinebetaine SCHEMBL15475722 | 0.83 | DNM1 (0.62) | DNM1RAD52NPSR1TSHRTP53 | |
| Glycinebetaine SCHEMBL15475765 | 0.83 | DNM1 (0.62) | DNM1RAD52NPSR1TSHRTP53 |
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 |
|---|---|---|---|---|---|---|---|
| US-6281176-B1 | Process for producing betaine/amine oxide mixtures | ALBEMARLE CORPORATION | 2001-08-28 | — | — | US | disclosed |