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 SCHEMBL28095415 | 1.00 | — | — | |
| Bicarbonate SCHEMBL28113744 | 0.86 | — | — | |
| Bicarbonate SCHEMBL7197393 | 0.86 | — | — | |
| Bicarbonate SCHEMBL28132938 | 0.86 | — | — | |
| Bicarbonate SCHEMBL30203844 | 0.86 | — | — | |
| Bicarbonate SCHEMBL11429625 | 0.86 | — | — | |
| Bicarbonate SCHEMBL18280952 | 0.86 | — | — | |
| Bicarbonate SCHEMBL1264801 | 0.86 | — | — | |
| Bicarbonate SCHEMBL30502415 | 0.86 | — | — | |
| Bicarbonate SCHEMBL6478072 | 0.84 | CA1 (1.00) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0986432-B1 | METHOD AND SYSTEM FOR SELECTIVE REMOVAL OF CONTAMINATION FROM GAS FLOWS | PROCEDE TWENTE BV (NL) | 2005-01-26 | — | — | EP | disclosed |
| EP-1496981-A2 | METHOD OF TREATING CANCER | Merck & Co., Inc. (US) | 2005-01-19 | — | — | EP | disclosed |
| WO-2003084473-A2 | METHOD OF TREATING CANCER | MERCK & CO., INC. (US) | 2003-10-16 | — | — | WO | disclosed |
| EP-0986432-A1 | METHOD AND SYSTEM FOR SELECTIVE REMOVAL OF CONTAMINATION FROM GAS FLOWS | Procede Twente BV (NL) | 2000-03-22 | — | — | EP | disclosed |
| WO-1998055209-A1 | METHOD AND SYSTEM FOR SELECTIVE REMOVAL OF CONTAMINATION FROM GAS FLOWS | PROCEDE TWENTE B.V. (NL) | 1998-12-10 | — | — | WO | disclosed |