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 SCHEMBL11411531 | 0.96 | — | — | |
| Bicarbonate SCHEMBL28246004 | 0.96 | CA1 (0.46) | — | |
| Bicarbonate SCHEMBL29242259 | 0.92 | CA1 (0.42) | — | |
| Oxalic Acid SCHEMBL27734305 | 0.83 | — | — | |
| Carbamic Acid SCHEMBL27769573 | 0.83 | — | — | |
| Cyanamide SCHEMBL11695507 | 0.82 | — | — | |
| Acetic Acid SCHEMBL5911373 | 0.80 | — | — | |
| Urea SCHEMBL11147505 | 0.78 | — | — | |
| Bicarbonate SCHEMBL28718961 | 0.78 | — | — | |
| Bicarbonate SCHEMBL8475691 | 0.77 | — | — |
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-114158555-A | Bactericide for preventing and treating plant canker and use method thereof | 西安嘉科农化有限公司 | 2022-03-11 | — | — | CN | disclosed |