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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL28149621 | 0.80 | LDHA (0.33) | — | |
| Bicarbonate SCHEMBL27146755 | 0.76 | — | — | |
| Bicarbonate SCHEMBL570968 | 0.74 | CA1 (1.00) | — | |
| Bicarbonate SCHEMBL6478072 | 0.74 | CA1 (1.00) | — | |
| Bicarbonate SCHEMBL8322803 | 0.74 | CA1 (1.00) | — | |
| Bicarbonate SCHEMBL1250901 | 0.74 | CA1 (1.00) | — | |
| Bicarbonate SCHEMBL570721 | 0.74 | CA1 (1.00) | — | |
| Bicarbonate SCHEMBL15271537 | 0.74 | — | — | |
| Bicarbonate SCHEMBL1179 | 0.74 | — | — | |
| Bicarbonate SCHEMBL11066368 | 0.74 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107556477-B | Fluorosilicone resin based on click chemistry and preparation method of self-repairing super-hydrophobic coating thereof | 西北工业大学 | 2021-06-15 | — | — | CN | disclosed |
| CN-1048006-C | Composite bone ash substitute and the bone china made with it | SHANDONG PROVINCIAL SILIATE RE (CN) | 2000-01-05 | — | — | CN | disclosed |
| CN-1126710-A | Composite bone ash substitute and the bone china made with it | SHANDONG PROV DESIGN INST OF C (CN) | 1996-07-17 | — | — | CN | disclosed |