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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL8954332 | 0.94 | CA4 (0.46) | — | |
| Bicarbonate SCHEMBL8969073 | 0.89 | — | — | |
| Bicarbonate SCHEMBL8969061 | 0.89 | — | — | |
| Bicarbonate SCHEMBL1817944 | 0.89 | CA4 (0.55) | — | |
| Bicarbonate SCHEMBL8503801 | 0.89 | — | — | |
| Bicarbonate SCHEMBL6407177 | 0.89 | CA4 (0.42) | — | |
| Bicarbonate SCHEMBL27274240 | 0.89 | — | — | |
| Bicarbonate SCHEMBL25 | 0.88 | — | — | |
| Bicarbonate SCHEMBL2121875 | 0.88 | CA4 (0.67) | — | |
| Bicarbonate SCHEMBL18155 | 0.88 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0458296-B1 | Modified epoxy resins having acetylenically unsaturated functions | NIPPON PAINT CO LTD (JP) | 1996-03-06 | — | — | EP | disclosed |
| EP-0458296-A2 | Modified epoxy resins having acetylenically unsaturated functions | NIPPON PAINT CO., LTD. (JP) | 1991-11-27 | — | — | EP | disclosed |