Bicarbonate

Bicarbonate

SCHEMBL19733170

CC(=O)C(C)C.O=C(O)O.O=C(O)O

nearest known ligand 0.57

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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 13)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.46
LCK P06239 1/20 0.46
FYN P06241 1/20 0.46
TP53 P04637 1/20 0.44
CA1 P00915 2/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
LMNA P02545 1/20 0.39
TSHR P16473 2/20 0.37
ALDH1A1 P00352 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
THPO P40225 1/20 0.36
SLC7A5 Q01650 1/20 0.35

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
SCHEMBL24113 0.91
SCHEMBL5051122 0.91 LMNA (0.46) FFAR3LCKFYNTP53CA1
SCHEMBL3226988 0.91
Hydrochloric Acid SCHEMBL529345 0.87
SCHEMBL3285880 0.87
Water SCHEMBL6154387 0.87
Methyl Alcohol SCHEMBL28405222 0.87
Ammonia Solution, Strong SCHEMBL6841304 0.87
SCHEMBL3287296 0.87
SCHEMBL30567580 0.87

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
EP-2438025-B1 MINERAL FIBER MAT CONTAINING A FORMALDEHYDE-TRAPPING AGENT, AND METHODS FOR MANUFACTURING SAME SAINT-GOBAIN ADFORS (FR) 2017-12-27 EP claimed