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 | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.35 |
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 SCHEMBL5868320 | 0.93 | CYP2C19 (0.43) | CYP2C19TSHRALDH1A1CYP1A2CYP2D6 | |
| Iodide SCHEMBL1054412 | 0.86 | HIF1A (0.50) | CYP2C19TSHRALDH1A1CYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL477383 | 0.86 | HIF1A (0.50) | CYP2C19TSHRALDH1A1CYP1A2CYP2D6 | |
| Bromide SCHEMBL161017 | 0.86 | HIF1A (0.50) | CYP2C19TSHRALDH1A1CYP1A2CYP2D6 | |
| Water SCHEMBL3422252 | 0.86 | HIF1A (0.50) | CYP2C19TSHRALDH1A1CYP1A2CYP2D6 | |
| Phosphoric Acid SCHEMBL8972516 | 0.85 | HIF1A (0.41) | CYP2C19TSHRALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL8972925 | 0.84 | HIF1A (0.44) | CYP2C19TSHRALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL28131525 | 0.84 | HIF1A (0.44) | CYP2C19TSHRALDH1A1CYP1A2CYP2D6 | |
| Perchlorate SCHEMBL11848103 | 0.84 | HIF1A (0.44) | CYP2C19TSHRALDH1A1CYP1A2CYP2D6 | |
| Phosphine SCHEMBL28043762 | 0.84 | HIF1A (0.48) | CYP2C19TSHRALDH1A1CYP1A2CYP2D6 |
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-5578694-A | MELT POLYCONDENSATION OF AROMATIC DIOL AND DIARYL CARBONATE; ESTER INTERCHANGE USING PHOSPHONIUM CATALYST | MITSUBISHI CHEMICAL CORPORATION (JP) | 1996-11-26 | — | — | US | disclosed |
| EP-0703262-A2 | Process for producing aromatic polycarbonate | Mitsubishi Chemical Corporation (JP) | 1996-03-27 | — | — | EP | disclosed |