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 SCHEMBL11651849 | 0.81 | — | — | |
| SCHEMBL1504447 | 0.76 | — | — | |
| SCHEMBL30958550 | 0.74 | — | — | |
| Ammonia Solution, Strong SCHEMBL3663452 | 0.74 | — | — | |
| SCHEMBL31400384 | 0.74 | — | — | |
| SCHEMBL5091223 | 0.74 | — | — | |
| SCHEMBL17687683 | 0.74 | — | — | |
| Water SCHEMBL3330190 | 0.74 | — | — | |
| Fluoride SCHEMBL9317915 | 0.74 | — | — | |
| Bicarbonate SCHEMBL564201 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9391345-B2 | Non-aqueous electrolytes for electrochemical cells | UCHICAGO ARGONNE, LLC (US) | 2016-07-12 | — | — | US | disclosed |
| US-20120082890-A1 | NON-AQUEOUS ELECTROLYTES FOR ELECTROCHEMICAL CELLS | UCHICAGO ARGONNE, LLC | 2012-04-05 | — | — | US | disclosed |