Known targets — ChEMBL curated mechanism
ADORA1ADORA2AADORA2BADORA3GNRHRMPLPDE3APDE3BPDE4APDE4BPDE4CPDE4DPPARASLC5A2
The experimentally established mechanism targets of Choline. 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 | |
|---|---|---|---|---|
| Choline SCHEMBL28133468 | 1.00 | — | — | |
| Choline SCHEMBL512465 | 1.00 | — | — | |
| Choline SCHEMBL28083629 | 0.96 | — | — | |
| Choline SCHEMBL27966594 | 0.96 | — | — | |
| Choline SCHEMBL27966620 | 0.96 | — | — | |
| Choline SCHEMBL27998285 | 0.96 | — | — | |
| Choline SCHEMBL28225819 | 0.96 | — | — | |
| Choline SCHEMBL28225937 | 0.96 | — | — | |
| Choline SCHEMBL8012313 | 0.96 | MEN1 (0.92) | — | |
| Choline SCHEMBL29394392 | 0.96 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-111744464-B | Adsorbent with bifunctional ligand and preparation method thereof | 北京中科太康科技有限公司 | 2023-03-24 | — | — | CN | claimed |
| EP-3694931-B1 | SURFACE COATING | UNIV COURT UNIV OF EDINBURGH (GB) | 2022-12-21 | — | — | EP | claimed |
| CN-120192906-A | Escherichia coli recombinant engineering bacteria for producing citicoline and construction method and application thereof | 广东筑美生物医疗科技有限公司 | 2025-06-24 | — | — | CN | disclosed |
| CN-115484950-A | Agents for use in the treatment of tissue damage | UCL商业有限责任公司 | 2022-12-16 | — | — | CN | disclosed |