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 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
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 SCHEMBL9492587 | 0.92 | CA1 (0.39) | CA1CA2CA9 | |
| Bicarbonate SCHEMBL18685960 | 0.89 | CA1 (0.36) | CA1CA2CA9 | |
| Benzene SCHEMBL626626 | 0.89 | CA9 (0.36) | CA1CA2CA9 | |
| Cyclooctane SCHEMBL9815451 | 0.86 | CA1 (0.33) | CA1CA2CA9 | |
| Cyclopentane SCHEMBL525206 | 0.86 | CA1 (0.33) | CA1CA2CA9 | |
| Bicarbonate SCHEMBL3784747 | 0.86 | CA1 (0.33) | CA1CA2CA9 | |
| Cyclohexane SCHEMBL10358872 | 0.86 | CA1 (0.33) | CA1CA2CA9 | |
| Butane SCHEMBL727081 | 0.81 | FFAR3 (0.36) | — | |
| SCHEMBL262924 | 0.78 | TSHR (0.36) | — | |
| Tetrahydrofuran SCHEMBL4424029 | 0.76 | ALDH1A1 (0.42) | — |
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-0523468-B1 | Silicone imides | SIEMENS AG (DE) | 1996-10-09 | — | — | EP | claimed |
| EP-0523468-A1 | Silicone imides | SIEMENS AKTIENGESELLSCHAFT (DE) | 1993-01-20 | — | — | EP | claimed |
| EP-0523468-B1 | Silicone imides | SIEMENS AG (DE) | 1996-10-09 | — | — | EP | disclosed |
| EP-0523468-A1 | Silicone imides | SIEMENS AKTIENGESELLSCHAFT (DE) | 1993-01-20 | — | — | EP | disclosed |