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 SCHEMBL8419166 | 0.93 | ACHE (0.40) | — | |
| Carbamic Acid SCHEMBL346428 | 0.92 | — | — | |
| SCHEMBL6328814 | 0.91 | LMNA (0.50) | — | |
| SCHEMBL4395 | 0.91 | — | — | |
| Water SCHEMBL7434763 | 0.87 | — | — | |
| Phosphine SCHEMBL3417770 | 0.87 | — | — | |
| Ammonia Solution, Strong SCHEMBL28286260 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL989724 | 0.87 | — | — | |
| SCHEMBL28555068 | 0.87 | — | — | |
| Bromide SCHEMBL5485388 | 0.87 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004045501-A2 | GLYCOPROTEIN CLEAVAGE PROTOCOL FOR OLIGOSACCHARIDE ANALYSIS | ADVANCED RESEARCH AND TECHNOLOGY INSTITUTE, INC. (US) | 2004-06-03 | — | — | WO | disclosed |
| US-20040096948-A1 | Glycoprotein cleavage protocol for oligosaccharide analysis | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2004-05-20 | — | — | US | disclosed |