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 SCHEMBL28502389 | 0.63 | LMNA (0.54) | — | |
| Butadiene SCHEMBL5086702 | 0.63 | LMNA (0.54) | — | |
| Butadiene SCHEMBL37186 | 0.63 | — | — | |
| Bicarbonate SCHEMBL5974518 | 0.63 | — | — | |
| Bicarbonate SCHEMBL6423684 | 0.63 | — | — | |
| Bicarbonate SCHEMBL4345305 | 0.62 | — | — | |
| Allyl Alcohol SCHEMBL27117738 | 0.62 | TSHR (0.69) | — | |
| Bicarbonate SCHEMBL9010689 | 0.62 | ABCC4 (0.50) | — | |
| Allyl Alcohol SCHEMBL465193 | 0.62 | — | — | |
| Bicarbonate SCHEMBL27372669 | 0.62 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1991000301-A1 | (CO)POLYMER MODIFICATION EMPLOYING UNSATURATED t-ALKYL PEROXYALKENYL CARBONATES | AKZO N.V. (NL) | 1991-01-10 | — | — | WO | disclosed |