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 SCHEMBL27445554 | 0.93 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL28255222 | 0.93 | — | — | |
| Bicarbonate SCHEMBL33316 | 0.93 | — | — | |
| Bicarbonate SCHEMBL11799110 | 0.93 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL2514665 | 0.93 | — | — | |
| Bicarbonate SCHEMBL7773868 | 0.93 | — | — | |
| Bicarbonate SCHEMBL20747 | 0.93 | — | — | |
| Bicarbonate SCHEMBL10619774 | 0.93 | — | — | |
| Bicarbonate SCHEMBL9576809 | 0.93 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL9576854 | 0.86 | CA1 (0.71) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101429270-B | Preparation method of polyacrylate modified polyurethane aqueous dispersion | UNIV HONG KONG SCIENCE & TECHN | 2013-04-10 | — | — | CN | disclosed |
| CN-101974141-A | Preparation method of water-based polyacrylate modified polyurethane dispersion (PUD) | HKKUST FOK YING TUNG GRADUATE SCHOOL | 2011-02-16 | — | — | CN | disclosed |
| CN-101429270-A | Preparation method of polyacrylate modified polyurethane aqueous dispersion | UNIV HONG KONG SCIENCE & TECHN (HK) | 2009-05-13 | — | — | CN | disclosed |
| US-5836962-A | Endoprosthesis | SCHNEIDER (EUROPE) AG (CH) | 1998-11-17 | — | — | US | disclosed |