Bicarbonate

Bicarbonate

SCHEMBL1332486

O=[12C]([O-])O.[Na+]

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 SCHEMBL5403678 1.00 CA4 (0.60)
Bicarbonate SCHEMBL1929377 1.00
Bicarbonate SCHEMBL83 1.00
Bicarbonate SCHEMBL15321596 1.00 CA4 (0.60)
Bicarbonate SCHEMBL1332636 1.00
Bicarbonate SCHEMBL9638573 1.00 CA4 (0.60)
Bicarbonate SCHEMBL222994 1.00 CA4 (0.60)
Bicarbonate SCHEMBL10646323 1.00 CA4 (0.60)
Bicarbonate SCHEMBL8468228 0.94 CA1 (0.56)
Bicarbonate SCHEMBL9247593 0.94 CA1 (0.56)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115236954-B CF (carbon fiber) process negative photoresist reworking liquid and preparation method and application thereof 易安爱富(武汉)科技有限公司 2024-12-10 CN disclosed
US-9673030-B2 Computer readable storage mediums, methods and systems for normalizing chemical profiles in biological or medical samples detected by mass spectrometry EMORY UNIVERSITY (US) 2017-06-06 US disclosed
US-20110282587-A1 COMPUTER READABLE STORAGE MEDIUMS, METHODS AND SYSTEMS FOR NORMALIZING CHEMICAL PROFILES IN BIOLOGICAL OR MEDICAL SAMPLES DETECTED BY MASS SPECTROMETRY EMORY UNIVERSITY (US) 2011-11-17 US disclosed