Bicarbonate

Bicarbonate

SCHEMBL28044388

O=C([O-])[O-].O=S([O-])[O-].[Ca+2].[Ca+2]

nearest known ligand 0.36

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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 4)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.36
CA4 P22748 3/20 0.36
FAHD1 Q6P587 1/20 0.36
CA2 P00918 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 SCHEMBL3802190 0.96 CA1 (0.33) CA1CA4FAHD1
Bicarbonate SCHEMBL11228006 0.91
Bicarbonate SCHEMBL3326642 0.91 CA4 (0.46) CA1CA4FAHD1CA2
Sulfuric Acid SCHEMBL11215157 0.86 MEN1 (0.33)
Bicarbonate SCHEMBL5586484 0.80
Sulfurous Acid SCHEMBL27336542 0.80
Bicarbonate SCHEMBL532723 0.80 CA4 (0.50) CA1CA4FAHD1CA2
Bicarbonate SCHEMBL1331961 0.80
Bicarbonate SCHEMBL711064 0.80 CA4 (0.50) CA1CA4FAHD1CA2
Bicarbonate SCHEMBL3261 0.80

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
CN-103880058-B A kind of precipitated chalk production technique of falling magnesium increasing calcium HEBEI UNIVERSITY OF TECHNOLOGY (CN) 2016-01-20 CN disclosed