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 SCHEMBL27472455 | 0.95 | — | — | |
| Carbamic Acid SCHEMBL20502633 | 0.80 | — | — | |
| Oxalic Acid SCHEMBL28540174 | 0.80 | LDHA (0.33) | — | |
| Bicarbonate SCHEMBL6553065 | 0.80 | — | — | |
| Bicarbonate SCHEMBL5332176 | 0.80 | CA1 (0.55) | — | |
| Bicarbonate SCHEMBL1908229 | 0.80 | CA1 (0.55) | — | |
| Bicarbonate SCHEMBL19897289 | 0.76 | — | — | |
| Bicarbonate SCHEMBL29353480 | 0.76 | — | — | |
| Bicarbonate SCHEMBL29657166 | 0.76 | — | — | |
| Bicarbonate SCHEMBL6478072 | 0.74 | CA1 (1.00) | — |
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-105745197-B | cyclic carbonate azide | 阿克苏诺贝尔化学品国际有限公司 | 2018-02-23 | — | — | CN | disclosed |