Bicarbonate

Bicarbonate

SCHEMBL2028638

O.O=C([O-])O.O=C([O-])O.[Ni+2]

nearest known ligand 0.42

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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 16)

geneUniProtsupporting neighboursconfidence
CA4 P22748 5/20 0.42
CA1 P00915 3/20 0.42
FAHD1 Q6P587 1/20 0.42
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
LMNA P02545 2/20 0.33
MEN1 O00255 1/20 0.33
LDHA P00338 1/20 0.33
BLM P54132 1/20 0.33
KMT2A Q03164 1/20 0.33
ACHE P22303 1/20 0.33
FFAR3 O14843 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33
OR51E2 Q9H255 1/20 0.31
CASP1 P29466 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 SCHEMBL9950136 0.95
Bicarbonate SCHEMBL2023099 0.95 CA4 (0.39) CA4CA1FAHD1CA2CA9
Bicarbonate SCHEMBL28221610 0.94 CA4 (0.46) CA4CA1FAHD1CA2CA9
Bicarbonate SCHEMBL2125897 0.94
Bicarbonate SCHEMBL1498980 0.89 CA4 (0.42) CA4CA1FAHD1CA2CA9
Bicarbonate SCHEMBL176206 0.89
Bicarbonate SCHEMBL472827 0.89
Bicarbonate SCHEMBL9442743 0.89 CA4 (0.55) CA4CA1FAHD1CA2CA9
Bicarbonate SCHEMBL4790627 0.89
Bicarbonate SCHEMBL175847 0.89 CA4 (0.42) CA4CA1FAHD1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2380688-A1 Particles and Inks and Films Using Them Fry's Metals, Inc. (US) 2011-10-26 EP disclosed
US-7968008-B2 Particles and inks and films using them FRY'S METALS, INC. (US) 2011-06-28 US disclosed