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 SCHEMBL21056248 | 1.00 | — | — | |
| Bicarbonate SCHEMBL11671968 | 0.94 | — | — | |
| Bicarbonate SCHEMBL28064756 | 0.94 | — | — | |
| Bicarbonate SCHEMBL10353161 | 0.93 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL7563121 | 0.93 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL18989451 | 0.93 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL17309693 | 0.93 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL300524 | 0.93 | — | — | |
| Bicarbonate SCHEMBL11678451 | 0.93 | CA1 (0.83) | — | |
| Bicarbonate SCHEMBL9467175 | 0.93 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-117799268-A | Flexible moisture-driven power generation film capable of being prepared on large scale and application thereof | 大连理工大学 | 2024-04-02 | — | — | CN | disclosed |
| CN-113621955-A | Pretreatment composition | PPG工业俄亥俄公司 | 2021-11-09 | — | — | CN | disclosed |
| US-20210292907-A1 | Pretreatment Composition | PPG INDUSTRIES OHIO, INC. (US) | 2021-09-23 | — | — | US | disclosed |
| EP-3497262-A1 | PRETREATMENT COMPOSITION | PPG Industries Ohio, Inc. (US) | 2019-06-19 | — | — | EP | disclosed |
| CN-109642326-A | PRETREATMENT COMPOSITION | PPG工业俄亥俄公司 | 2019-04-16 | — | — | CN | disclosed |