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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.70 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.70 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.46 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | LIPG | Q9Y5X9 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.42 |
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 SCHEMBL7568966 | 0.91 | AKR1C3 (0.60) | AKR1C3AKR1C1SLC18A3 | |
| Bicarbonate SCHEMBL7576375 | 0.90 | AKR1C3 (0.57) | AKR1C3AKR1C1NPC1RAB9ASIGMAR1 | |
| Bicarbonate SCHEMBL1720488 | 0.90 | AKR1C3 (0.63) | AKR1C3AKR1C1NPC1RAB9ASIGMAR1 | |
| Bicarbonate SCHEMBL7573346 | 0.90 | AKR1C3 (0.63) | AKR1C3AKR1C1NPC1RAB9ASIGMAR1 | |
| SCHEMBL10895189 | 0.90 | AKR1C3 (0.61) | AKR1C3AKR1C1SIGMAR1SLC18A3GAA | |
| SCHEMBL7572183 | 0.87 | AKR1C3 (0.67) | AKR1C3AKR1C1NPC1RAB9ASIGMAR1 | |
| SCHEMBL3144653 | 0.86 | AKR1C3 (0.64) | AKR1C3AKR1C1NPC1RAB9ASIGMAR1 | |
| SCHEMBL14433729 | 0.83 | AKR1C3 (0.72) | AKR1C3AKR1C1NPC1RAB9ASIGMAR1 | |
| SCHEMBL17292430 | 0.83 | AKR1C3 (0.72) | AKR1C3AKR1C1NPC1RAB9ASIGMAR1 | |
| SCHEMBL1073107 | 0.83 | AKR1C3 (1.00) | AKR1C3AKR1C1NPC1RAB9ASIGMAR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0926118-B1 | Process for the purification of bisphenols and preparation of polycarbonates therefrom | GEN ELECTRIC (US) | 2002-09-11 | — | — | EP | disclosed |
| US-6008315-A | REACTING A PHENOL AND A KETONE TO FORM BISPHENOL IN SOLUTION OR A MIXED SOLUTION OF PHENOL AND BISPHENOL, AND THE IMPROVEMENT COMPRISES FILTERING IN A NONCONTAMINATING, HEAT RESISTANT, REUSABLE CALCINED METAL FILTER | GENERAL ELECTRIC COMPANY (US) | 1999-12-28 | — | — | US | disclosed |
| EP-0926118-A1 | Process for the purification of bisphenols and preparation of polycarbonates therefrom | GENERAL ELECTRIC COMPANY (US) | 1999-06-30 | — | — | EP | disclosed |