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 SCHEMBL1830889 | 1.00 | MEN1 (0.36) | — | |
| Acetic Acid SCHEMBL1832152 | 0.91 | — | — | |
| Oxalic Acid SCHEMBL1837735 | 0.91 | KDM4E (0.39) | — | |
| Sulfuric Acid SCHEMBL5028523 | 0.89 | KDM4A (0.32) | — | |
| Glycolic Acid SCHEMBL1831337 | 0.88 | LDHA (0.35) | — | |
| Sulfuric Acid SCHEMBL5546505 | 0.87 | KDM4A (0.32) | — | |
| SCHEMBL15225 | 0.87 | — | — | |
| SCHEMBL6247615 | 0.87 | CARM1 (0.37) | — | |
| Succinic Acid SCHEMBL1833489 | 0.86 | EGLN1 (0.47) | — | |
| Pyruvate SCHEMBL1831472 | 0.86 | ALDH1A1 (0.37) | — |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20070185330-A1 | Liquids | THE UNIVERSITY OF YORK (GB) | 2007-08-09 | — | — | US | claimed |
| CN-114805902-B | Carbonic acid alcohol amine salt foaming agent composition for polyurethane rigid foam | 山东理工大学 | 2024-01-19 | — | — | CN | disclosed |
| CN-117279971-A | Polyol complex liquid composition for producing hydrochlorofluoroolefin foam polyurethane foam and use thereof | 东曹株式会社 | 2023-12-22 | — | — | CN | disclosed |
| WO-2022160439-A1 | ALKANOLAMINE CARBONATE FOAMING AGENT COMPOSITION FOR POLYURETHANE RIGID FOAM | 山东理工大学 | 2022-08-04 | — | — | WO | disclosed |
| CN-114805902-A | Carbonic acid alkanolamine salt foaming agent composition for polyurethane rigid foam | 山东理工大学 | 2022-07-29 | — | — | CN | disclosed |
| US-9328220-B2 | Liquids | INNOVIA FILMS LIMITED (GB) | 2016-05-03 | — | — | US | disclosed |
| US-8992798-B2 | Liquids | INNOVIA FILMS LIMITED (GB) | 2015-03-31 | — | — | US | disclosed |
| US-8784686-B2 | Liquids | INNOVIA FILMS LIMITED (GB) | 2014-07-22 | — | — | US | disclosed |
| US-20140187684-A1 | LIQUIDS | INNOVIA FILMS LIMITED (GB) | 2014-07-03 | — | — | US | disclosed |
| US-20120041088-A1 | FOAMING ADDITIVE FOR PRODUCING POLYURETHANE FOAM, AND METHOD FOR PRODUCING RIGID POLYURETHANE FOAM BY USING IT | TOSOH CORPORATION (JP) | 2012-02-16 | — | — | US | disclosed |
| US-20110257433-A1 | LIQUIDS | THE UNIVERSITY OF YORK (GB) | 2011-10-20 | — | — | US | disclosed |
| EP-2322497-A1 | Ionic liquids comprising nitrogen containing cations | Innovia Films Limited (GB) | 2011-05-18 | — | — | EP | disclosed |
| CN-101316810-A | Ionic liquids | BIONIQS LTD (GB) | 2008-12-03 | — | — | CN | disclosed |
| US-20080221361-A1 | Ionic Liquids | BIONIQS LIMITED (GB) | 2008-09-11 | — | — | US | disclosed |
| US-20070185330-A1 | Liquids | THE UNIVERSITY OF YORK (GB) | 2007-08-09 | — | — | US | disclosed |