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 SCHEMBL8829823 | 0.92 | — | — | |
| Bicarbonate SCHEMBL28313744 | 0.89 | FFAR3 (0.45) | — | |
| Bicarbonate SCHEMBL4357848 | 0.88 | — | — | |
| Acetic Acid SCHEMBL9796816 | 0.85 | — | — | |
| Oxalic Acid SCHEMBL28863990 | 0.85 | CA4 (0.50) | — | |
| Oxalic Acid SCHEMBL29240050 | 0.85 | CA4 (0.50) | — | |
| Propionic Acid SCHEMBL28884837 | 0.81 | — | — | |
| Oxalic Acid SCHEMBL3627632 | 0.81 | CA4 (0.47) | — | |
| Acetic Acid SCHEMBL9621652 | 0.81 | — | — | |
| Bicarbonate SCHEMBL7017269 | 0.81 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112370475-A | Process for extracting total flavonoids in mugwort by supercritical carbon dioxide | 内蒙古东绿生态科技研究院有限公司 | 2021-02-19 | — | — | CN | claimed |
| CN-116713040-A | Modification method and application of ion exchange resin for gallium purification | 广西师范大学 | 2023-09-08 | — | — | CN | disclosed |
| CN-112370475-A | Process for extracting total flavonoids in mugwort by supercritical carbon dioxide | 内蒙古东绿生态科技研究院有限公司 | 2021-02-19 | — | — | CN | disclosed |