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 SCHEMBL28656357 | 0.84 | CA2 (0.50) | — | |
| Bicarbonate SCHEMBL28136957 | 0.84 | CA2 (0.50) | — | |
| Acetic Acid SCHEMBL11656191 | 0.80 | — | — | |
| Bicarbonate SCHEMBL28226829 | 0.80 | ALDH1A1 (0.47) | — | |
| Trifluoroacetic Acid SCHEMBL9228519 | 0.80 | CA2 (0.46) | — | |
| Bicarbonate SCHEMBL28722588 | 0.80 | — | — | |
| Bicarbonate SCHEMBL21051129 | 0.77 | CA2 (0.42) | — | |
| Bicarbonate SCHEMBL27146755 | 0.76 | — | — | |
| Bicarbonate SCHEMBL1179 | 0.74 | — | — | |
| Bicarbonate SCHEMBL15271537 | 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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113214425-A | Modified polytetrafluoroethylene and preparation method and application thereof | 深圳市圣一科技有限公司 | 2021-08-06 | — | — | CN | claimed |
| CN-115101815-A | Electrolyte and lithium ion battery | 联动天翼新能源有限公司 | 2022-09-23 | — | — | CN | disclosed |
| CN-113214425-A | Modified polytetrafluoroethylene and preparation method and application thereof | 深圳市圣一科技有限公司 | 2021-08-06 | — | — | CN | disclosed |
| CN-213517624-U | Hydrophobic stain-resistant lens | 中山市骏锐光学器材科技有限公司 | 2021-06-22 | — | — | CN | disclosed |
| CN-112993270-A | Catalyst, and electrode catalyst layer, membrane electrode assembly, and fuel cell using same | 日产自动车株式会社 | 2021-06-18 | — | — | CN | disclosed |
| CN-105228741-B | Catalyst, and electrode catalyst layer, membrane electrode assembly, and fuel cell using same | 日产自动车株式会社 | 2019-12-06 | — | — | CN | disclosed |