Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Betaine. 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 | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.34 |
| ▸ | EIF4H | Q15056 | 1/20 | 0.34 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | TERT | O14746 | 1/20 | 0.32 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Betaine SCHEMBL1628919 | 0.87 | TSHR (0.42) | TSHRALDH1A1LMNAAPEX1 | |
| SCHEMBL3072750 | 0.85 | HTT (0.50) | HTTALDH1A1PABPC1EIF4HCTDSP1 | |
| Betaine SCHEMBL8958510 | 0.84 | LMNA (0.40) | TSHRHTTALDH1A1LMNAAPEX1 | |
| Betaine SCHEMBL953768 | 0.84 | TDP1 (0.36) | TSHRALDH1A1LMNAAPEX1PABPC1 | |
| Water SCHEMBL1047262 | 0.83 | HTT (0.48) | HTTALDH1A1PABPC1EIF4HCTDSP1 | |
| SCHEMBL22655253 | 0.80 | HTT (0.53) | HTTALDH1A1LMNAKMT2ACYP3A4 | |
| Betaine SCHEMBL3421777 | 0.79 | TSHR (0.33) | TSHRALDH1A1LMNAAPEX1 | |
| Betaine SCHEMBL9688200 | 0.79 | NPSR1 (0.45) | HTTALDH1A1LMNAKMT2A | |
| Betaine SCHEMBL7046211 | 0.78 | TSHR (0.45) | TSHRALDH1A1LMNAAPEX1KMT2A | |
| SCHEMBL28431855 | 0.75 | PABPC1 (0.43) | HTTALDH1A1LMNAPABPC1EIF4H |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5534129-A | Cyanidic-alkaline baths for the galvanic deposition of copper-tin alloy coatings, uses thereof, and metallic bases coated with said copper-tin alloy coating | DEGUSSA AKTIENGESELLSCHAFT (DE) | 1996-07-09 | — | — | US | claimed |
| US-5534129-A | Cyanidic-alkaline baths for the galvanic deposition of copper-tin alloy coatings, uses thereof, and metallic bases coated with said copper-tin alloy coating | DEGUSSA AKTIENGESELLSCHAFT (DE) | 1996-07-09 | — | — | US | disclosed |