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 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BBOX1 | O75936 | 5/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30869346 | 0.91 | BBOX1 (0.42) | BBOX1 | |
| Bicarbonate SCHEMBL30869368 | 0.89 | ALDH1A1 (0.31) | — | |
| Methoxyacetic Acid SCHEMBL17418327 | 0.88 | BBOX1 (0.43) | BBOX1 | |
| SCHEMBL17418749 | 0.88 | BBOX1 (0.51) | BBOX1 | |
| SCHEMBL17418910 | 0.88 | BBOX1 (0.51) | BBOX1 | |
| SCHEMBL17418159 | 0.88 | BBOX1 (0.51) | BBOX1 | |
| Bicarbonate SCHEMBL30869338 | 0.88 | ALDH1A1 (0.37) | BBOX1 | |
| SCHEMBL30869349 | 0.87 | BBOX1 (0.39) | BBOX1 | |
| SCHEMBL1277012 | 0.87 | DNM1 (0.36) | BBOX1 | |
| Bicarbonate SCHEMBL30869326 | 0.86 | BBOX1 (0.43) | BBOX1 |
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-117813334-A | Onium salt, blocking agent dissociation catalyst for blocking isocyanate, blocked isocyanate composition containing blocking agent dissociation catalyst, thermosetting resin composition, cured product, and method for producing same | 广荣化学株式会社 | 2024-04-02 | — | — | CN | disclosed |