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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CTH | P32929 | 1/20 | 0.39 |
| ▸ | CBS | P35520 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | LDHA | P00338 | 1/20 | 0.33 |
| ▸ | LDHB | P07195 | 1/20 | 0.33 |
| ▸ | OR51E2 | Q9H255 | 2/20 | 0.31 |
| ▸ | GLRA1 | P23415 | 1/20 | 0.31 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 SCHEMBL6382508 | 1.00 | — | — | |
| SCHEMBL49346 | 0.95 | — | — | |
| Ammonia Solution, Strong SCHEMBL1553477 | 0.91 | — | — | |
| SCHEMBL472294 | 0.91 | — | — | |
| SCHEMBL2237797 | 0.91 | — | — | |
| SCHEMBL3272308 | 0.91 | — | — | |
| Ammonia Solution, Strong SCHEMBL964524 | 0.91 | — | — | |
| SCHEMBL1883360 | 0.91 | — | — | |
| SCHEMBL20695616 | 0.91 | — | — | |
| SCHEMBL2353572 | 0.91 | — | — |
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-0661255-B1 | Process for producing diol compounds | UBE INDUSTRIES (JP) | 1998-03-04 | — | — | EP | disclosed |
| US-5536888-A | Process for producing diol compounds | UBE INDUSTRIES, LTD. (JP) | 1996-07-16 | — | — | US | disclosed |
| EP-0661255-A1 | Process for producing diol compounds | UBE INDUSTRIES, LTD. (JP) | 1995-07-05 | — | — | EP | disclosed |