Bicarbonate

Bicarbonate

SCHEMBL6285987

CCC#C[Si](C)(C)C.O=C(O)O

nearest known ligand 0.32

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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 3)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.32
GRIK1 P39086 1/20 0.31
GRIK2 Q13002 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 SCHEMBL167201 0.76 FFAR3 (0.44) FFAR3GRIK1GRIK2
Bicarbonate SCHEMBL15967910 0.76 FFAR3 (0.44) FFAR3GRIK1GRIK2
SCHEMBL12621542 0.70
SCHEMBL6272882 0.70 EPHX2 (0.38) FFAR3
Bicarbonate SCHEMBL5538707 0.69
SCHEMBL73409 0.69
SCHEMBL31627275 0.67
SCHEMBL31627244 0.67
SCHEMBL7315206 0.67 PTPN7 (0.50)
Hydrochloric Acid SCHEMBL1569440 0.67

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-6867161-B1 Titanium catalyst and organotitanium reacting reagent, production thereof, and reaction thereby NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2005-03-15 US disclosed
EP-0820809-A1 TITANIUM CATALYST, ORGANOTITANIUM REACTION REAGENT, PROCESSES FOR PRODUCING THESE, AND METHOD OF REACTION USING THESE NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1998-01-28 EP disclosed