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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 SCHEMBL3967769 | 0.88 | MAPT (0.41) | — | |
| Acetic Acid SCHEMBL21634319 | 0.88 | — | — | |
| Acetic Acid SCHEMBL9339876 | 0.88 | MAPT (0.41) | — | |
| Acrylic Acid SCHEMBL10650130 | 0.88 | LMNA (0.56) | — | |
| SCHEMBL11589496 | 0.87 | TSHR (0.50) | — | |
| SCHEMBL1836 | 0.87 | — | — | |
| Maleic Acid SCHEMBL27216247 | 0.86 | TSHR (0.47) | — | |
| Acetic Acid SCHEMBL9622091 | 0.86 | MAPT (0.39) | — | |
| Urea SCHEMBL240189 | 0.85 | — | — | |
| Bicarbonate SCHEMBL9010689 | 0.83 | ABCC4 (0.50) | — |
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-0767228-B1 | Curable coating composition having carbonate-containing component | BASF CORP (US) | 2001-01-31 | — | — | EP | disclosed |
| US-5756213-A | Curable coating composition having carbonate-containing component | BASF CORPORATION (US) | 1998-05-26 | — | — | US | disclosed |
| EP-0767228-A1 | Curable coating composition having carbonate-containing component | BASF CORPORATION (US) | 1997-04-09 | — | — | EP | disclosed |