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 SCHEMBL27689523 | 1.00 | CA1 (0.71) | — | |
| Bicarbonate SCHEMBL31498918 | 0.93 | — | — | |
| Bicarbonate SCHEMBL7156658 | 0.86 | — | — | |
| Bicarbonate SCHEMBL10821926 | 0.86 | — | — | |
| Bicarbonate SCHEMBL29735146 | 0.86 | — | — | |
| Bicarbonate SCHEMBL23200397 | 0.86 | — | — | |
| Bicarbonate SCHEMBL15669383 | 0.86 | — | — | |
| Bicarbonate SCHEMBL708160 | 0.86 | — | — | |
| Bicarbonate SCHEMBL9056813 | 0.86 | — | — | |
| Bicarbonate SCHEMBL675541 | 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-1938244-B | Fluoridation method | GE HEALTHCARE LTD | 2013-03-13 | — | — | CN | disclosed |
| CN-1938244-A | Fluoridation method | GE HEALTHCARE LTD (GB) | 2007-03-28 | — | — | CN | disclosed |