Bicarbonate

Bicarbonate

SCHEMBL8410024

CC[N+](CC)(CC)CCO.O=C([O-])O

nearest known ligand 0.40

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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 20)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 2/20 0.35
DNM1 Q05193 4/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
KCNA1 Q09470 1/20 0.33
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP3A4 P08684 1/20 0.32
SLC5A7 Q9GZV3 1/20 0.32
KDM4E B2RXH2 1/20 0.32
PMP22 Q01453 1/20 0.32
ATM Q13315 1/20 0.32
FFAR3 O14843 2/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31

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 SCHEMBL8410039 0.92 BBOX1 (0.37) BBOX1DNM1CHRM2CHRM1CHRM3
Acetic Acid SCHEMBL320127 0.90 CA1 (0.40) BBOX1DNM1TSHRNFKB1KCNA1
Bicarbonate SCHEMBL8857321 0.90 BBOX1 (0.35) BBOX1DNM1CHRM2CHRM1CHRM3
Bicarbonate SCHEMBL8857423 0.90 TSHR (0.37) DNM1CHRM2CHRM1CHRM3TSHR
Fumaric Acid SCHEMBL2353231 0.84 CA1 (0.40) BBOX1DNM1
Fumaric Acid SCHEMBL2355570 0.84 CA1 (0.40) BBOX1DNM1
Fumaric Acid SCHEMBL2353238 0.84 CA1 (0.40) BBOX1DNM1
SCHEMBL476985 0.84 TSHR (0.47) DNM1TSHRNFKB1KCNA1MEN1
Bicarbonate SCHEMBL8857012 0.83 SLC22A1 (0.48) BBOX1DNM1FFAR3HDAC3HDAC1
Acrylic Acid SCHEMBL2354037 0.82 TSHR (0.34) BBOX1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5693599-A Flux washing agent MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1997-12-02 US claimed
JP-11050285-A None JP disclosed
CN-116617403-B Amino acid modified ionic liquid and preparation method and application thereof 北京大学 2026-05-19 CN disclosed
CN-116617403-A Amino acid modified ionic liquid and preparation method and application thereof 北京大学 2023-08-22 CN disclosed
JP-H1150285-A PRODUCTION OF HIGH-PURITY BETA-HYDROXYETHYLTRIETHYL AMMONIUM HYDROXIDE NIPPON HIDORAJIN KOGYO KK 1999-02-23 JP disclosed
US-5693599-A Flux washing agent MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1997-12-02 US disclosed
US-5538832-A Developing solution for producing printed circuit boards and a process for producing printed circuit boards wherein the developing solution comprises a quaternary ammonium hydroxide and a quaternary ammonium carbonate MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1996-07-23 US disclosed