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 SCHEMBL81420 | 0.94 | — | — | |
| Bicarbonate SCHEMBL13725824 | 0.94 | CA1 (0.71) | — | |
| Bicarbonate SCHEMBL28317678 | 0.94 | — | — | |
| Bicarbonate SCHEMBL27590117 | 0.94 | — | — | |
| Bicarbonate SCHEMBL8105626 | 0.94 | — | — | |
| Bicarbonate SCHEMBL8042496 | 0.88 | CA1 (0.62) | — | |
| Bicarbonate SCHEMBL4610140 | 0.88 | CA1 (0.62) | — | |
| Bicarbonate SCHEMBL6580023 | 0.88 | — | — | |
| Bicarbonate SCHEMBL81418 | 0.88 | — | — | |
| Bicarbonate SCHEMBL669861 | 0.88 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0522744-B1 | Synthesis gas production | ICI PLC (GB) | 1997-08-13 | — | — | EP | disclosed |
| US-5252609-A | Catalytic steam reforming first stream of desulfurized hydrocarbon feedstock, cooling; adiabatically low temperature steam reforming second stream, partially oxidizing and cooling and mixing two streams | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-10-12 | — | — | US | disclosed |
| EP-0522744-A2 | Synthesis gas production | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-01-13 | — | — | EP | disclosed |