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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | BBOX1 | O75936 | 8/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 5/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.33 |
| ▸ | GALR3 | O60755 | 2/20 | 0.33 |
| ▸ | HTR1A | P08908 | 2/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.33 |
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 SCHEMBL718083 | 0.93 | BBOX1 (0.35) | ALDH1A1BBOX1CHRM5CHRM1CHRM3 | |
| Bicarbonate SCHEMBL5072374 | 0.90 | ALDH1A1 (0.39) | ALDH1A1BBOX1CHRM5CHRM1CHRM3 | |
| Bicarbonate SCHEMBL30869368 | 0.90 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL30869363 | 0.88 | CHRM5 (0.38) | ALDH1A1BBOX1CHRM5CHRM1CHRM3 | |
| Bicarbonate SCHEMBL29201353 | 0.86 | CHRM1 (0.48) | ALDH1A1CHRM5CHRM1CHRM3CHRM2 | |
| Methoxyacetic Acid SCHEMBL17418848 | 0.85 | BBOX1 (0.35) | BBOX1CHRM5CHRM1CHRM3CHRM2 | |
| SCHEMBL26428507 | 0.82 | BBOX1 (0.36) | ALDH1A1BBOX1CHRM5CHRM1CHRM3 | |
| SCHEMBL12583479 | 0.82 | HTT (0.32) | LMNA | |
| Bicarbonate SCHEMBL30869338 | 0.81 | ALDH1A1 (0.37) | ALDH1A1BBOX1SMN1; SMN2TSHR | |
| Bicarbonate SCHEMBL30869315 | 0.80 | BBOX1 (0.48) | ALDH1A1BBOX1CHRM5CHRM1CHRM3 |
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 |