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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BBOX1 | O75936 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 4/20 | 0.33 |
| ▸ | SLC22A16 | Q86VW1 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | ALPL | P05186 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | ALPG | P10696 | 1/20 | 0.31 |
| ▸ | CPT2 | P23786 | 1/20 | 0.31 |
| ▸ | CPT1A | P50416 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CA4 | P22748 | 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 SCHEMBL9499586 | 0.88 | BBOX1 (0.39) | BBOX1TP53CA1SLC22A16CA2 | |
| Acetic Acid SCHEMBL319665 | 0.88 | CA1 (0.50) | BBOX1CA1SLC22A16CA2CPT2 | |
| Bicarbonate SCHEMBL9503263 | 0.84 | TP53 (0.37) | BBOX1TP53CA1CA2CA4 | |
| L-Lactic Acid SCHEMBL3820376 | 0.82 | TP53 (0.38) | BBOX1TP53CA1SLC22A16CA2 | |
| SCHEMBL10643640 | 0.80 | BBOX1 (0.35) | BBOX1SLC22A16 | |
| SCHEMBL144709 | 0.79 | — | — | |
| Bicarbonate SCHEMBL11740655 | 0.78 | TP53 (0.44) | BBOX1TP53CA1SLC22A16CA2 | |
| SCHEMBL9752218 | 0.75 | — | — | |
| Tetramethylammonium Ion SCHEMBL108420 | 0.75 | — | — | |
| Water SCHEMBL190437 | 0.75 | — | — |
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-B1 | PROCESS FOR PRODUCING A HIGH PURITY QUATERNARY AMMONIUM HYDROXIDE | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1993-04-21 | — | — | EP | claimed |