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 | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | BCHE | P06276 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | THRB | P10828 | 2/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
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 SCHEMBL28169982 | 0.98 | CYP1A2 (0.61) | SMN1; SMN2CYP1A2MAPK1ALDH1A1KDM4E | |
| Acetic Acid SCHEMBL16700360 | 0.93 | CYP1A2 (0.55) | SMN1; SMN2CYP1A2MAPK1ALDH1A1KDM4E | |
| Oxalic Acid SCHEMBL27342756 | 0.91 | ALDH1A1 (0.61) | SMN1; SMN2CYP1A2MAPK1ALDH1A1KDM4E | |
| Acetic Acid SCHEMBL28667322 | 0.91 | CYP1A2 (0.59) | SMN1; SMN2CYP1A2MAPK1ALDH1A1KDM4E | |
| SCHEMBL172368 | 0.88 | — | — | |
| SCHEMBL28057560 | 0.88 | HRH3 (0.60) | SMN1; SMN2CYP1A2MAPK1ALDH1A1HRH3 | |
| SCHEMBL4914238 | 0.88 | — | — | |
| Acetic Acid SCHEMBL15820572 | 0.87 | CYP1A2 (0.53) | SMN1; SMN2CYP1A2MAPK1ALDH1A1KDM4E | |
| Trifluoroacetic Acid SCHEMBL16701135 | 0.86 | CYP1A2 (0.48) | SMN1; SMN2CYP1A2MAPK1ALDH1A1KDM4E | |
| Maleic Acid SCHEMBL27441586 | 0.86 | CYP1A2 (0.53) | SMN1; SMN2CYP1A2MAPK1ALDH1A1KDM4E |
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-104592164-B | A kind of preparation method of ionic liquid | 微宏动力系统（湖州）有限公司 | 2017-08-29 | — | — | CN | disclosed |