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 | |
|---|---|---|---|---|
| ▸ | GSK3B known ✓ | P49841 | 2/20 | 0.38 |
| ▸ | KIF11 | P52732 | 8/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
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 SCHEMBL11284778 | 0.91 | CYP2C19 (0.45) | KIF11HIF1ACYP2C19CYP1A2MAPT | |
| Acetic Acid SCHEMBL5074931 | 0.91 | CYP2C19 (0.45) | KIF11HIF1ACYP2C19CYP1A2MAPT | |
| SCHEMBL766983 | 0.90 | KIF11 (0.46) | KIF11CYP2C19CYP1A2MAPK1SMN1; SMN2 | |
| Water SCHEMBL11171777 | 0.87 | KIF11 (0.44) | KIF11CYP2C19CYP1A2MAPK1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL660294 | 0.87 | KIF11 (0.44) | KIF11CYP2C19CYP1A2SMN1; SMN2ALDH1A1 | |
| SCHEMBL10995938 | 0.87 | KIF11 (0.44) | KIF11CYP2C19CYP1A2MAPK1SMN1; SMN2 | |
| Iodide SCHEMBL660827 | 0.87 | KIF11 (0.44) | KIF11CYP2C19CYP1A2MAPK1SMN1; SMN2 | |
| Bromide SCHEMBL110208 | 0.87 | KIF11 (0.44) | KIF11CYP2C19CYP1A2MAPK1SMN1; SMN2 | |
| Bicarbonate SCHEMBL8616457 | 0.79 | KIF11 (0.53) | KIF11CYP2C19CYP3A4 | |
| SCHEMBL29152090 | 0.77 | KIF11 (0.38) | KIF11CYP2C19CYP1A2ALDH1A1TSHR |
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-4354015-A | HIGH MOLECULAR WEIGHT LINEAR EPOXY RESINS | THE DOW CHEMICAL COMPANY (US) | 1982-10-12 | — | — | US | claimed |
| US-4354015-A | HIGH MOLECULAR WEIGHT LINEAR EPOXY RESINS | THE DOW CHEMICAL COMPANY (US) | 1982-10-12 | — | — | US | disclosed |