Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Bicarbonate. 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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL4773693 | 0.86 | FFAR3 (0.47) | — | |
| Bicarbonate SCHEMBL29004812 | 0.84 | — | — | |
| Bicarbonate SCHEMBL28492777 | 0.83 | — | — | |
| Oxalic Acid SCHEMBL28706460 | 0.81 | ALOX15 (0.37) | — | |
| Butane SCHEMBL1716773 | 0.79 | — | — | |
| Butane SCHEMBL21633593 | 0.79 | FFAR3 (0.54) | — | |
| Butane SCHEMBL1329645 | 0.79 | FFAR3 (0.54) | — | |
| Butane SCHEMBL40275 | 0.79 | FFAR3 (0.54) | — | |
| Butane SCHEMBL1165212 | 0.79 | FFAR3 (0.54) | — | |
| Bicarbonate SCHEMBL28406982 | 0.79 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-119547225-A | Negative electrode for secondary battery and secondary battery | 株式会社村田制作所 | 2025-02-28 | — | — | CN | disclosed |