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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL9395678 | 0.93 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL9398103 | 0.93 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL11166404 | 0.93 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL11133737 | 0.93 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL8440459 | 0.93 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL9636303 | 0.93 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL11619417 | 0.93 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL8859987 | 0.93 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL7520782 | 0.93 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL2786367 | 0.86 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110085919-A | All-solid-state battery electrolyte interface modification method and application thereof | 哈尔滨工业大学 | 2019-08-02 | — | — | CN | disclosed |
| CN-103698314-A | Method for fast detection of residual sulfur dioxide in food | UNIV XIAMEN | 2014-04-02 | — | — | CN | disclosed |