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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A1 | O15245 | 3/20 | 0.55 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.48 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
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 SCHEMBL8857309 | 0.98 | SLC22A1 (0.52) | SLC22A1SLC22A2DNM1SMN1; SMN2ALDH1A1 | |
| Bicarbonate SCHEMBL8856951 | 0.93 | SLC22A1 (0.52) | SLC22A1SLC22A2DNM1SMN1; SMN2ALDH1A1 | |
| Tetrabuthylammonium SCHEMBL106861 | 0.91 | SLC22A1 (0.67) | SLC22A1SLC22A2DNM1SMN1; SMN2ALDH1A1 | |
| Bicarbonate SCHEMBL30507730 | 0.89 | SLC22A1 (0.52) | SLC22A1SLC22A2DNM1SMN1; SMN2ALDH1A1 | |
| Bicarbonate SCHEMBL8856948 | 0.88 | SLC22A1 (0.57) | SLC22A1SLC22A2DNM1SMN1; SMN2ALDH1A1 | |
| Tetrabuthylammonium SCHEMBL193669 | 0.88 | SLC22A1 (0.63) | SLC22A1SLC22A2DNM1SMN1; SMN2ALDH1A1 | |
| Tetrabuthylammonium SCHEMBL21372575 | 0.88 | SLC22A1 (0.63) | SLC22A1SLC22A2DNM1SMN1; SMN2ALDH1A1 | |
| Tetrabuthylammonium SCHEMBL16343940 | 0.88 | SLC22A1 (0.63) | SLC22A1SLC22A2DNM1SMN1; SMN2ALDH1A1 | |
| Bicarbonate SCHEMBL28716225 | 0.88 | SLC22A1 (0.63) | SLC22A1SLC22A2DNM1SMN1; SMN2ALDH1A1 | |
| SCHEMBL5072396 | 0.88 | SLC22A1 (0.71) | SLC22A1SLC22A2DNM1SMN1; SMN2ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5693599-A | Flux washing agent | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1997-12-02 | — | — | US | claimed |
| US-5693599-A | Flux washing agent | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1997-12-02 | — | — | US | disclosed |