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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.64 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.54 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | LCK | P06239 | 1/20 | 0.52 |
| ▸ | PPARD | Q03181 | 1/20 | 0.52 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.52 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.52 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL4809786 | 0.91 | ACE2 (0.59) | ACE2GPR84FFAR1MAPTLCK | |
| Bicarbonate SCHEMBL6439327 | 0.91 | ACE2 (0.76) | ACE2GPR84FFAR1MAPTLCK | |
| Bicarbonate SCHEMBL28584877 | 0.91 | CA2 (0.54) | ACE2GPR84FFAR1MAPTCA1 | |
| Bicarbonate SCHEMBL28895715 | 0.91 | CA2 (0.54) | ACE2GPR84FFAR1MAPTCA1 | |
| Bicarbonate SCHEMBL885152 | 0.91 | CA2 (0.54) | ACE2GPR84FFAR1MAPTCA1 | |
| Bicarbonate SCHEMBL216624 | 0.91 | CA2 (0.54) | ACE2GPR84FFAR1MAPTCA1 | |
| Bicarbonate SCHEMBL9230330 | 0.88 | CA2 (0.52) | ACE2GPR84FFAR1MAPTCA1 | |
| Bicarbonate SCHEMBL973799 | 0.88 | CA2 (0.52) | ACE2GPR84FFAR1MAPTCA1 | |
| SCHEMBL4406475 | 0.88 | ACE2 (0.52) | ACE2GPR84FFAR1 | |
| SCHEMBL672720 | 0.88 | ACE2 (0.52) | ACE2GPR84FFAR1 |
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-2306968-B1 | COSMETIC COMPOSITION CONTAINING A SILICONE ACRYLATE AND A POLYESTER WAX | CHANEL PARFUMS BEAUTÉ (FR) | 2016-12-07 | — | — | EP | claimed |