Bicarbonate

Bicarbonate

SCHEMBL8909804

CCCc1cccc(O)c1O.O=C(O)O

nearest known ligand 0.67

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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 9)

geneUniProtsupporting neighboursconfidence
IAPP P10997 4/20 0.67
PRKCI P41743 1/20 0.51
BID P55957 3/20 0.50
MCL1 Q07820 3/20 0.50
BCL2L1 Q07817 2/20 0.50
BAK1 Q16611 2/20 0.50
ELANE P08246 1/20 0.50
CTSG P08311 1/20 0.50
KAT8 Q9H7Z6 1/20 0.50

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
Acetic Acid SCHEMBL28002759 0.94 IAPP (0.66) IAPPPRKCIBIDMCL1BCL2L1
SCHEMBL68921 0.92 IAPP (0.65) IAPPPRKCIELANECTSG
Toluene SCHEMBL27530782 0.92 IAPP (0.58) IAPPPRKCIBIDMCL1BCL2L1
SCHEMBL27438781 0.90 IAPP (0.62) IAPPPRKCIELANECTSG
SCHEMBL28032839 0.90 IAPP (0.62) IAPPPRKCIELANECTSG
Water SCHEMBL27676525 0.90 IAPP (0.62) IAPPPRKCIELANECTSG
Methyl Alcohol SCHEMBL27475042 0.90 IAPP (0.62) IAPPPRKCIELANECTSG
SCHEMBL27848644 0.90 IAPP (0.62) IAPPPRKCIELANECTSG
Bromide SCHEMBL27499802 0.90 IAPP (0.62) IAPPPRKCIELANECTSG
SCHEMBL27397030 0.90 IAPP (0.62) IAPPPRKCIELANECTSG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5681669-A ORGANIC SOLVENT CONTAINING AN AROMATIC CARBONATE AND DISSOLVED LITHIUM SALT UBE INDUSTRIES, LTD. (JP) 1997-10-28 US disclosed