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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | APEX1 | P27695 | 1/20 | 0.47 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PGK1 | P00558 | 1/20 | 0.32 |
| ▸ | PGK2 | P07205 | 1/20 | 0.32 |
| ▸ | PGD | P52209 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29582 | 0.81 | — | — | |
| SCHEMBL904474 | 0.79 | TSHR (0.43) | TSHRSMPD1PGK1PGK2 | |
| Phosphoric Acid SCHEMBL21408828 | 0.79 | TSHR (0.43) | TSHRSMPD1PGK1PGK2 | |
| Methacrylic Acid SCHEMBL25437430 | 0.75 | PEPD (0.36) | TSHRSMPD1PGK1PGK2PGD | |
| Acrylic Acid SCHEMBL22576754 | 0.75 | LMNA (0.37) | TSHRALDH1A1LMNASMPD1PGK1 | |
| Ether SCHEMBL15974122 | 0.74 | TSHR (0.39) | TSHRSMPD1 | |
| Betaine SCHEMBL134333 | 0.69 | — | — | |
| Betaine SCHEMBL399905 | 0.69 | TSHR (1.00) | TSHRALDH1A1LMNAAPEX1MAPT | |
| Betaine SCHEMBL2385363 | 0.69 | TSHR (0.54) | TSHRALDH1A1LMNAAPEX1MAPT | |
| SCHEMBL7152553 | 0.68 | TSHR (0.46) | TSHRSMPD1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112240173-B | Foam circulation-based oil-gas well sand washing method, defoaming liquid for oil-gas well sand washing and foaming liquid | 中国石油化工股份有限公司 | 2023-06-02 | — | — | CN | claimed |
| CN-112240173-A | Oil and gas well sand washing and well flushing method based on foam circulation, and defoaming solution and foaming solution for oil and gas well sand washing and well flushing | 中国石油化工股份有限公司 | 2021-01-19 | — | — | CN | claimed |
| WO-2019242233-A1 | METHOD FOR MODIFYING GRAPHENE, MODIFIED GRAPHENE, AND COMPOSITION CONTAINING GRAPHENE | 东旭科技集团有限公司 | 2019-12-26 | — | — | WO | claimed |
| CN-112240173-B | Foam circulation-based oil-gas well sand washing method, defoaming liquid for oil-gas well sand washing and foaming liquid | 中国石油化工股份有限公司 | 2023-06-02 | — | — | CN | disclosed |
| CN-109761325-B | Composite regulating agent and method for precipitation conversion and flotation removal of metal ions in wastewater | 郑州大学 | 2021-09-24 | — | — | CN | disclosed |
| CN-108384650-B | Surfactant composition | 广州蓝月亮实业有限公司 | 2021-03-16 | — | — | CN | disclosed |
| CN-108441337-B | Surfactant composition | 广州蓝月亮实业有限公司 | 2021-03-16 | — | — | CN | disclosed |
| CN-112240173-A | Oil and gas well sand washing and well flushing method based on foam circulation, and defoaming solution and foaming solution for oil and gas well sand washing and well flushing | 中国石油化工股份有限公司 | 2021-01-19 | — | — | CN | disclosed |