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 | |
|---|---|---|---|---|
| SCHEMBL127444 | 0.83 | — | — | |
| Benzene SCHEMBL28180746 | 0.80 | CA1 (0.35) | — | |
| Bicarbonate SCHEMBL29153717 | 0.74 | LMNA (0.41) | — | |
| Bicarbonate SCHEMBL27532496 | 0.74 | LMNA (0.41) | — | |
| SCHEMBL3857042 | 0.72 | — | — | |
| Bicarbonate SCHEMBL28268547 | 0.72 | LMNA (0.39) | — | |
| Bicarbonate SCHEMBL28268548 | 0.72 | LMNA (0.39) | — | |
| Bicarbonate SCHEMBL28502389 | 0.70 | LMNA (0.54) | — | |
| Bicarbonate SCHEMBL6423684 | 0.70 | — | — | |
| Butadiene SCHEMBL37186 | 0.70 | — | — |
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-101132075-B | Stable electrolyte-pair anion for electrochemical device | AIR PROD & CHEM | 2010-11-24 | — | — | CN | disclosed |
| CN-101132075-A | Stable electrolyte-pair anion for electrochemical device | AIR PROD & CHEM (US) | 2008-02-27 | — | — | CN | disclosed |