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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CPB1 | P15086 | 1/20 | 0.33 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.32 |
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 SCHEMBL10653462 | 1.00 | ALDH1A1 (0.35) | ALDH1A1HPGDHSD17B10CPB1TAS2R38 | |
| SCHEMBL8424470 | 0.90 | — | — | |
| SCHEMBL10656774 | 0.90 | — | — | |
| Bicarbonate SCHEMBL10657637 | 0.76 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL3392640 | 0.74 | — | — | |
| Bicarbonate SCHEMBL10653430 | 0.71 | ALDH1A1 (0.43) | ALDH1A1HPGD | |
| Bicarbonate SCHEMBL10657592 | 0.69 | KDM4E (0.39) | ALDH1A1 | |
| Sulfuric Acid SCHEMBL8058531 | 0.68 | BLM (0.39) | CPB1 | |
| SCHEMBL5972914 | 0.65 | PHF8 (0.50) | ALDH1A1 | |
| Thiosemicarbazide SCHEMBL11417436 | 0.64 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0176546-B1 | ISOTHIURONIUM SALTS | PEREMARTONI VEGYIPARI VALLALAT (HU) | 1988-03-02 | — | — | EP | disclosed |
| US-4710578-A | ANTITUMOR AGENTS, MITICIDES | PEREMARTONI VEGYIPARI VALLALAT (HU) | 1987-12-01 | — | — | US | disclosed |
| EP-0176546-A1 | ISOTHIURONIUM SALTS. | PEREMARTONI VEGYIPARI VALLALAT (HU) | 1986-04-09 | — | — | EP | disclosed |
| WO-1985004399-A1 | ISOTHIURONIUM SALTS | PEREMARTONI VEGYIPARI VÁLLALAT (HU) | 1985-10-10 | — | — | WO | disclosed |