Bicarbonate

Bicarbonate

SCHEMBL4451318

O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=[Zr+2].O=[Zr+2].[Al+3].[Al+3]

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

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
CA4 P22748 5/20 0.42
CA1 P00915 2/20 0.42
FAHD1 Q6P587 1/20 0.42
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
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 SCHEMBL262245 0.94
Bicarbonate SCHEMBL578313 0.89 CA4 (0.55) CA4CA1FAHD1LMNAMEN1
Bicarbonate SCHEMBL440938 0.89 CA4 (0.42) CA4CA1FAHD1LMNAMEN1
Bicarbonate SCHEMBL2496023 0.89 CA4 (0.42) CA4CA1FAHD1LMNAMEN1
Bicarbonate SCHEMBL10535508 0.89
Bicarbonate SCHEMBL578285 0.89 CA4 (0.55) CA4CA1FAHD1LMNAMEN1
Bicarbonate SCHEMBL19511112 0.89 CA4 (0.42) CA4CA1FAHD1LMNAMEN1
Bicarbonate SCHEMBL19128 0.88 CA4 (0.50) CA4CA1FAHD1LMNAMEN1
Bicarbonate SCHEMBL950160 0.82
Bicarbonate SCHEMBL17685557 0.82 CA4 (0.46) CA4CA1FAHD1LMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7491766-B2 Aqueous emulsion and use thereof THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO., LTD. (JP) 2009-02-17 US disclosed
EP-1571161-B1 Aqueous emulsion and use thereof NIPPON SYNTHETIC CHEM IND (JP) 2007-05-16 EP disclosed
US-20050197441-A1 Aqueous emulsion and use thereof THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO., LTD. 2005-09-08 US disclosed
EP-1571161-A1 Aqueous emulsion and use thereof Nippon Synthetic Chemical Industry Co., Ltd (JP) 2005-09-07 EP disclosed