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 | |
|---|---|---|---|---|
| ▸ | BBOX1 | O75936 | 3/20 | 0.42 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
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 SCHEMBL1896982 | 0.97 | BBOX1 (0.43) | BBOX1FFAR3HDAC3HDAC1HDAC2 | |
| Bicarbonate SCHEMBL9499506 | 0.89 | BBOX1 (0.42) | BBOX1FFAR3HDAC3HDAC1HDAC2 | |
| Acetic Acid SCHEMBL3684341 | 0.89 | CA1 (0.44) | BBOX1FFAR3HDAC3HDAC1HDAC2 | |
| Propionic Acid SCHEMBL5573582 | 0.86 | BBOX1 (0.45) | BBOX1FFAR3HDAC3HDAC1HDAC2 | |
| Bicarbonate SCHEMBL29127597 | 0.82 | TSHR (0.43) | FFAR3HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL10644192 | 0.82 | CHRM5 (0.43) | BBOX1FFAR3HDAC3HDAC1HDAC2 | |
| Pivalate SCHEMBL4928408 | 0.82 | BBOX1 (0.39) | BBOX1FFAR3HDAC3HDAC1HDAC2 | |
| Butyric Acid SCHEMBL5574341 | 0.82 | FFAR3 (0.67) | BBOX1FFAR3HDAC3HDAC1HDAC2 | |
| SCHEMBL5574362 | 0.82 | CYP3A4 (0.41) | BBOX1FFAR3HDAC3HDAC1HDAC2 | |
| Bicarbonate SCHEMBL2279601 | 0.81 | DNM1 (0.55) | BBOX1ACHEDNM1SMN1; SMN2CES2 |
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-0269949-A2 | Process for producing a high purity quaternary ammonium hydroxide | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1988-06-08 | — | — | EP | disclosed |