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 SCHEMBL19410354 | 1.00 | TSHR (0.50) | — | |
| Bicarbonate SCHEMBL9488228 | 0.95 | TSHR (0.56) | — | |
| Bicarbonate SCHEMBL28880335 | 0.95 | TSHR (0.56) | — | |
| Bicarbonate SCHEMBL310739 | 0.95 | — | — | |
| Bicarbonate SCHEMBL28468139 | 0.90 | — | — | |
| Bicarbonate SCHEMBL11775796 | 0.90 | TSHR (0.50) | — | |
| Bicarbonate SCHEMBL28043204 | 0.90 | — | — | |
| Bicarbonate SCHEMBL28227077 | 0.86 | TSHR (0.46) | — | |
| Acetic Acid SCHEMBL7203369 | 0.82 | — | — | |
| Cyclohexane SCHEMBL15408354 | 0.82 | TSHR (0.42) | — |
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-114975866-A | Negative pole piece treating fluid, surface-modified negative pole piece and lithium ion battery | 比亚迪股份有限公司 | 2022-08-30 | — | — | CN | disclosed |