Bicarbonate

Bicarbonate

SCHEMBL5488857

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

nearest known ligand 0.00

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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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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 SCHEMBL6673355 1.00 CA4 (0.42)
Bicarbonate SCHEMBL15513824 0.95 CA4 (0.39)
Bicarbonate SCHEMBL410564 0.95 CA4 (0.39)
Bicarbonate SCHEMBL14563794 0.95 CA4 (0.39)
Bicarbonate SCHEMBL950160 0.94
Bicarbonate SCHEMBL4705259 0.94 CA4 (0.46)
Bicarbonate SCHEMBL7515523 0.94
Bicarbonate SCHEMBL489862 0.94 CA4 (0.46)
Bicarbonate SCHEMBL17747962 0.91 CA4 (0.36)
Bicarbonate SCHEMBL14562576 0.91 CA4 (0.46)

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
US-20070249758-A1 Method for Grinding Mineral Materials in the Presence of Binders, Resulting Aqueous Suspensions and Use Thereof COATEX S.A.S. (FR) 2007-10-25 US claimed
EP-0290881-B1 PROCESS FOR PREPARING LIGHTWEIGHT CONSTRUCTION ELEMENTS STO AKTIENGESELLSCHAFT (DE) 1992-07-15 EP claimed