Bicarbonate

Bicarbonate

SCHEMBL19689366

C1CCC(N2CCCCC2)CC1.O=C(O)O

nearest known ligand 0.62

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Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

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.

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 9/20 0.50
L3MBTL1 Q9Y468 7/20 0.50
MBTD1 Q05BQ5 5/20 0.50
POLB P06746 2/20 0.50
HSD17B10 Q99714 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 1/20 0.47
TP53BP1 Q12888 1/20 0.47
L3MBTL4 Q8NA19 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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.

Compoundsimilaritytop predictedshared targets
Bicarbonate SCHEMBL11101479 1.00 L3MBTL3 (0.50) L3MBTL3L3MBTL1MBTD1POLBHSD17B10
Acetic Acid SCHEMBL11275843 0.91 MEN1 (0.47) L3MBTL3L3MBTL1MBTD1POLBHSD17B10
Bicarbonate SCHEMBL7269762 0.90 L3MBTL3 (0.50) L3MBTL3L3MBTL1MBTD1POLBHSD17B10
Bicarbonate SCHEMBL7272578 0.87 ALDH1A1 (0.50) L3MBTL3L3MBTL1MBTD1POLBHSD17B10
Glycolic Acid SCHEMBL11244860 0.87 MEN1 (0.49) L3MBTL3L3MBTL1MBTD1POLBHSD17B10
SCHEMBL24782761 0.87 HTR6 (0.54) L3MBTL3L3MBTL1MBTD1POLBHSD17B10
SCHEMBL22216666 0.87 HTR6 (0.54) L3MBTL3L3MBTL1MBTD1POLBHSD17B10
SCHEMBL21057351 0.87 HTR6 (0.54) L3MBTL3L3MBTL1MBTD1POLBHSD17B10
SCHEMBL21057384 0.87 HTR6 (0.54) L3MBTL3L3MBTL1MBTD1POLBHSD17B10
SCHEMBL21422636 0.87 HTR6 (0.54) L3MBTL3L3MBTL1MBTD1POLBHSD17B10

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10975477-B2 Methods and systems for the electrochemical reduction of carbon dioxide using switchable polarity materials BATTELLE ENERGY ALLIANCE, LLC (US) 2021-04-13 US claimed
US-20200255958-A1 METHODS AND SYSTEMS FOR THE ELECTROCHEMICAL REDUCTION OF CARBON DIOXIDE USING SWITCHABLE POLARITY MATERIALS UNITED STATES DEPARTMENT OF ENERGY 2020-08-13 US claimed
EP-3691771-A1 METHODS AND SYSTEMS FOR THE ELECTROCHEMICAL REDUCTION OF CARBON DIOXIDE USING SWITCHABLE POLARITY MATERIALS Battelle Energy Alliance, LLC (US) 2020-08-12 EP claimed
EP-3691771-B1 METHODS AND SYSTEMS FOR THE ELECTROCHEMICAL REDUCTION OF CARBON DIOXIDE USING SWITCHABLE POLARITY MATERIALS BATTELLE ENERGY ALLIANCE LLC (US) 2023-08-16 EP disclosed
US-10975477-B2 Methods and systems for the electrochemical reduction of carbon dioxide using switchable polarity materials BATTELLE ENERGY ALLIANCE, LLC (US) 2021-04-13 US disclosed
US-20200255958-A1 METHODS AND SYSTEMS FOR THE ELECTROCHEMICAL REDUCTION OF CARBON DIOXIDE USING SWITCHABLE POLARITY MATERIALS UNITED STATES DEPARTMENT OF ENERGY 2020-08-13 US disclosed
EP-3691771-A1 METHODS AND SYSTEMS FOR THE ELECTROCHEMICAL REDUCTION OF CARBON DIOXIDE USING SWITCHABLE POLARITY MATERIALS Battelle Energy Alliance, LLC (US) 2020-08-12 EP disclosed
US-10195543-B2 Methods and systems for treating a switchable polarity material, and related methods of liquid treatment BATTELLE ENERGY ALLIANCE, LLC (US) 2019-02-05 US disclosed
US-20170354904-A1 METHODS AND SYSTEMS FOR TREATING A SWITCHABLE POLARITY MATERIAL, AND RELATED METHODS OF LIQUID TREATMENT U.S. DEPARTMENT OF ENERGY 2017-12-14 US disclosed