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 SCHEMBL8475689 | 0.90 | — | — | |
| Bicarbonate SCHEMBL993009 | 0.89 | — | — | |
| Bicarbonate SCHEMBL28756022 | 0.89 | CA4 (0.60) | — | |
| Bicarbonate SCHEMBL991933 | 0.89 | CA4 (0.60) | — | |
| Bicarbonate SCHEMBL7322065 | 0.89 | CA4 (0.60) | — | |
| Bicarbonate SCHEMBL993314 | 0.89 | CA4 (0.60) | — | |
| Bicarbonate SCHEMBL991844 | 0.89 | CA4 (0.60) | — | |
| Bicarbonate SCHEMBL175476 | 0.89 | — | — | |
| Bicarbonate SCHEMBL8533360 | 0.89 | CA4 (0.60) | — | |
| Bicarbonate SCHEMBL175477 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106892456-B | A method of optimization doping M phase hypovanadic oxide phase transition performances | 西南大学 | 2018-10-19 | — | — | CN | disclosed |
| CN-106892456-A | A kind of method for optimizing doping M phase hypovanadic oxide phase transition performances | 西南大学 | 2017-06-27 | — | — | CN | disclosed |