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 SCHEMBL4347606 | 0.88 | CA1 (0.71) | — | |
| Bicarbonate SCHEMBL688615 | 0.88 | CA1 (0.71) | — | |
| Bicarbonate SCHEMBL631215 | 0.88 | — | — | |
| Bicarbonate SCHEMBL7732430 | 0.88 | — | — | |
| Bicarbonate SCHEMBL27306298 | 0.88 | CA1 (0.71) | — | |
| Bicarbonate SCHEMBL3629001 | 0.88 | — | — | |
| Bicarbonate SCHEMBL1682603 | 0.82 | — | — | |
| Bicarbonate SCHEMBL28307089 | 0.82 | CA1 (0.62) | — | |
| Bicarbonate SCHEMBL10865888 | 0.82 | — | — | |
| Bicarbonate SCHEMBL28879270 | 0.82 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118320846-A | Preparation method and application of formaldehyde acetylized carbonate catalyst with acid-base controllability | 西安向阳航天材料股份有限公司 | 2024-07-12 | — | — | CN | claimed |
| CN-118320846-A | Preparation method and application of formaldehyde acetylized carbonate catalyst with acid-base controllability | 西安向阳航天材料股份有限公司 | 2024-07-12 | — | — | CN | disclosed |