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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.58 |
| ▸ | CHRNA7 | P36544 | 8/20 | 0.44 |
| ▸ | TRAP1 | Q12931 | 3/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 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 SCHEMBL7632167 | 0.98 | ALDH1A1 (0.59) | ALDH1A1CYP1A2CYP2D6TSHRCYP2C19 | |
| Bicarbonate SCHEMBL7629482 | 0.98 | ALDH1A1 (0.59) | ALDH1A1CYP1A2CYP2D6TSHRCYP2C19 | |
| Bicarbonate SCHEMBL7624436 | 0.98 | ALDH1A1 (0.59) | ALDH1A1CYP1A2CYP2D6TSHRCYP2C19 | |
| Oxalic Acid SCHEMBL7635783 | 0.94 | ALDH1A1 (0.59) | ALDH1A1CYP1A2CYP2D6TSHRCYP2C19 | |
| Oxalic Acid SCHEMBL7625166 | 0.92 | ALDH1A1 (0.57) | ALDH1A1CYP1A2CYP2D6TSHRCYP2C19 | |
| Oxalic Acid SCHEMBL7631795 | 0.92 | ALDH1A1 (0.57) | ALDH1A1CYP1A2CYP2D6TSHRCYP2C19 | |
| Oxalic Acid SCHEMBL7622903 | 0.92 | ALDH1A1 (0.57) | ALDH1A1CYP1A2CYP2D6TSHRCYP2C19 | |
| SCHEMBL28742554 | 0.90 | CYP2C19 (0.60) | ALDH1A1CYP1A2CYP2D6TSHRCYP2C19 | |
| Butyltriphenylphosphonium SCHEMBL328957 | 0.88 | ALDH1A1 (0.53) | ALDH1A1CYP1A2CYP2D6TSHRCYP2C19 | |
| Bicarbonate SCHEMBL8972399 | 0.87 | ALDH1A1 (0.67) | ALDH1A1CYP1A2CYP2D6TSHRCYP2C19 |
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-0780452-B1 | Aqueous paint | TOYO SEIKAN KAISHA LTD (JP) | 2002-03-06 | — | — | EP | disclosed |
| US-5763507-A | EPOXY ACRYLATE RESIN | TOYO SEIKAN KAISHA, LTD. (JP) | 1998-06-09 | — | — | US | disclosed |
| EP-0780452-A2 | Aqueous paint | TOYO SEIKAN KAISHA LIMITED (JP) | 1997-06-25 | — | — | EP | disclosed |