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 | |
|---|---|---|---|---|
| SCHEMBL6009401 | 0.93 | SMN1; SMN2 (0.30) | — | |
| SCHEMBL28362243 | 0.87 | — | — | |
| SCHEMBL4288419 | 0.85 | SMN1; SMN2 (0.30) | — | |
| Bicarbonate SCHEMBL28414950 | 0.84 | — | — | |
| SCHEMBL6009920 | 0.83 | — | — | |
| SCHEMBL25437809 | 0.81 | ALDH1A1 (0.35) | — | |
| Bicarbonate SCHEMBL29033358 | 0.81 | — | — | |
| Methoxymethane SCHEMBL29131245 | 0.80 | — | — | |
| Ethylene SCHEMBL4941985 | 0.80 | — | — | |
| Bicarbonate SCHEMBL1493986 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7229717-B2 | Tri-component active material including Sn; B, C, Al, or P; and Si, Mg, Ti, V, Cr, Mn, Fe, Co, Ni, Cu, Zn, Ga, Zr, Nb, Mo, Ag, In, Ce, Hf, Ta, W, or Bi; halogenated ethylene or propylene carbonate electrolyte solvent; high capacity and superior cycle characteristics | SONY CORPORATION (JP) | 2007-06-12 | — | — | US | disclosed |
| US-20060068285-A1 | Anode active material and battery using it | SONY CORPORATION (JP) | 2006-03-30 | — | — | US | disclosed |