Bicarbonate

Bicarbonate

SCHEMBL8679043

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nearest known ligand 0.46

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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 11)

geneUniProtsupporting neighboursconfidence
CA4 P22748 5/20 0.46
CA1 P00915 3/20 0.46
FAHD1 Q6P587 1/20 0.46
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.36
LDHA P00338 1/20 0.36
BLM P54132 1/20 0.36
KMT2A Q03164 1/20 0.36
CASP1 P29466 1/20 0.33
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30

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 SCHEMBL121569 0.94 CA4 (0.50) CA4CA1FAHD1LMNAMEN1
Bicarbonate SCHEMBL29678 0.94
Bicarbonate SCHEMBL8038418 0.88 CA4 (0.46) CA4CA1FAHD1LMNAMEN1
Bicarbonate SCHEMBL16653582 0.88
Bicarbonate SCHEMBL6523382 0.88
Bicarbonate SCHEMBL17685557 0.88 CA4 (0.46) CA4CA1FAHD1LMNAMEN1
Bicarbonate SCHEMBL21059504 0.88 CA4 (0.46) CA4CA1FAHD1LMNAMEN1
Bicarbonate SCHEMBL11293720 0.88
Bicarbonate SCHEMBL21680141 0.88
Bicarbonate SCHEMBL8954332 0.88 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5731036-A FORMING COPPER DIMETHYLDITHIOCARBAMATE ISK BIOSCIENCES CORPORATION (US) 1998-03-24 US disclosed