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.
Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 SCHEMBL3100323 | 0.91 | ALDH1A1 (0.40) | ALDH1A1SOAT1CYP2D6SMN1; SMN2 | |
| SCHEMBL18628625 | 0.90 | ALDH1A1 (0.41) | ALDH1A1SOAT1 | |
| Bicarbonate SCHEMBL18628626 | 0.85 | ALDH1A1 (0.35) | ALDH1A1SOAT1 | |
| SCHEMBL18628630 | 0.85 | ALDH1A1 (0.48) | ALDH1A1SOAT1CYP2D6SMN1; SMN2 | |
| Bicarbonate SCHEMBL16592514 | 0.83 | ALDH1A1 (0.50) | ALDH1A1SOAT1CYP2D6SMN1; SMN2 | |
| Bicarbonate SCHEMBL576994 | 0.83 | ALDH1A1 (0.48) | ALDH1A1SOAT1CYP2D6SMN1; SMN2 | |
| Bicarbonate SCHEMBL23282877 | 0.81 | TSHR (0.38) | ALDH1A1 | |
| Bicarbonate SCHEMBL27780973 | 0.81 | ALDH1A1 (0.46) | ALDH1A1SOAT1CYP2D6SMN1; SMN2 | |
| Bicarbonate SCHEMBL3105439 | 0.80 | ALDH1A1 (0.39) | ALDH1A1SOAT1CYP2D6SMN1; SMN2 | |
| SCHEMBL577237 | 0.79 | ALDH1A1 (0.52) | ALDH1A1SOAT1CYP2D6SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2144321-B1 | NONAQUEOUS ELECTROLYTE FOR SECONDARY BATTERY AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY EMPLOYING THE SAME | MITSUBISHI CHEM CORP (JP) | 2019-01-23 | — | — | EP | disclosed |