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 SCHEMBL5186944 | 1.00 | CA1 (0.39) | CA1CA2CA9 | |
| Bicarbonate SCHEMBL5709305 | 0.86 | CA1 (0.33) | CA1CA2CA9 | |
| Carbamic Acid SCHEMBL27514925 | 0.86 | ACHE (0.47) | — | |
| Acetic Acid SCHEMBL27640863 | 0.86 | FFAR3 (0.47) | — | |
| Acetone SCHEMBL27929595 | 0.81 | LMNA (0.43) | — | |
| SCHEMBL7015046 | 0.81 | — | — | |
| Benzene SCHEMBL1907770 | 0.79 | TP53 (0.30) | — | |
| SCHEMBL21859 | 0.78 | — | — | |
| SCHEMBL1112353 | 0.78 | — | — | |
| SCHEMBL28754303 | 0.78 | — | — |
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-1036127-B1 | ADHESIVE AND THE UTILIZATION THEREOF IN COMPOSITE MATERIALS | HENKEL KGAA (DE) | 2005-11-02 | — | — | EP | claimed |
| EP-1036127-B1 | ADHESIVE AND THE UTILIZATION THEREOF IN COMPOSITE MATERIALS | HENKEL KGAA (DE) | 2005-11-02 | — | — | EP | disclosed |
| EP-1036127-A1 | ADHESIVE AND THE UTILIZATION THEREOF IN COMPOSITE MATERIALS | Henkel Kommanditgesellschaft auf Aktien (DE) | 2000-09-20 | — | — | EP | disclosed |
| WO-1999028406-A1 | ADHESIVE AND THE UTILIZATION THEREOF IN COMPOSITE MATERIALS | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 1999-06-10 | — | — | WO | disclosed |