Bicarbonate

Bicarbonate

SCHEMBL28859124

C1=Cc2ccccc2NC1.O=C([O-])[O-].[Ca+2]

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

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 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
GAA P10253 1/20 0.38
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
P2RX4 Q99571 1/20 0.31
HSD17B3 P37058 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
Acetone SCHEMBL28015284 0.87 MAPT (0.39) MAPTGAARAB9ASMN1; SMN2P2RX4
SCHEMBL34295 0.87 GAA (0.48) MAPTGAA
SCHEMBL29415525 0.87 GAA (0.48) MAPTGAA
SCHEMBL28320372 0.85 GAA (0.46) MAPTGAA
SCHEMBL28397446 0.85 GAA (0.46) MAPTGAA
Hydrochloric Acid SCHEMBL27563992 0.85 GAA (0.46) MAPTGAA
SCHEMBL9683514 0.85 GAA (0.46) MAPTGAA
Potassium SCHEMBL9683518 0.85 GAA (0.46) MAPTGAA
SCHEMBL29587280 0.85 GAA (0.46) MAPTGAA
Acetone SCHEMBL27943930 0.83 MAPT (0.35) MAPTGAARAB9ASMN1; SMN2P2RX4

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
CN-108034119-A Bubble bags material 广东天元实业集团股份有限公司 2018-05-15 CN disclosed