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 SCHEMBL18989584 | 1.00 | CA4 (0.55) | — | |
| Bicarbonate SCHEMBL5072811 | 1.00 | — | — | |
| Bicarbonate SCHEMBL28035293 | 0.95 | — | — | |
| Bicarbonate SCHEMBL2132949 | 0.94 | CA4 (0.60) | — | |
| Bicarbonate SCHEMBL2562235 | 0.94 | — | — | |
| Bicarbonate SCHEMBL2302071 | 0.94 | CA4 (0.46) | — | |
| Bicarbonate SCHEMBL7115951 | 0.94 | — | — | |
| Bicarbonate SCHEMBL14562576 | 0.91 | CA4 (0.46) | — | |
| Bicarbonate SCHEMBL14562695 | 0.89 | — | — | |
| Bicarbonate SCHEMBL10909603 | 0.89 | — | — |
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-107879366-A | A kind of activation method that aluminum oxide is extracted from flyash | 昆明理工大学 | 2018-04-06 | — | — | CN | disclosed |