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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | LSS | P48449 | 2/20 | 0.31 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | KDM6B | O15054 | 1/20 | 0.31 |
| ▸ | KDM5C | P41229 | 1/20 | 0.31 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.31 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.31 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.31 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
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 SCHEMBL28060031 | 1.00 | ALDH1A1 (0.41) | ALDH1A1LMNAKDM4ETSHRMEN1 | |
| Acetic Acid SCHEMBL1077081 | 0.92 | ALDH1A1 (0.39) | ALDH1A1LMNAKDM4ETSHRMEN1 | |
| Propionic Acid SCHEMBL27807644 | 0.87 | FFAR3 (0.48) | ALDH1A1LMNATSHRABCC4MAPT | |
| Methacrylic Acid SCHEMBL28117137 | 0.85 | ALDH1A1 (0.35) | ALDH1A1LMNAKDM4EMEN1KMT2A | |
| Glycine SCHEMBL29866 | 0.85 | GLRA1 (0.46) | ALDH1A1LMNATSHRMEN1KMT2A | |
| SCHEMBL43114 | 0.85 | — | — | |
| SCHEMBL4177390 | 0.85 | — | — | |
| Acetamide SCHEMBL18319481 | 0.84 | LMNA (0.40) | ALDH1A1LMNATSHRMEN1KMT2A | |
| Methyl Alcohol SCHEMBL27760189 | 0.82 | — | — | |
| Hydroxyamine SCHEMBL27886493 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-105494337-A | Low-corrosivity ortho-phthalaldehyde disinfectant | NANJING JUSHA DISPLAY TECH CO LTD | 2016-04-20 | — | — | CN | claimed |
| CN-105494337-A | Low-corrosivity ortho-phthalaldehyde disinfectant | NANJING JUSHA DISPLAY TECH CO LTD | 2016-04-20 | — | — | CN | disclosed |