Bicarbonate

Bicarbonate

SCHEMBL28068895

N=C(N)N[N+](=O)[O-].O=C(O)O

nearest known ligand 0.38

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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 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.38
LMNA P02545 3/20 0.36
MAPK1 P28482 1/20 0.32
NOS1 P29475 2/20 0.30
NOS3 P29474 1/20 0.30
NOS2 P35228 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
SCHEMBL27577885 0.92 ALDH1A1 (0.41) ALDH1A1TP53LMNAMAPK1
SCHEMBL107616 0.92
Acetic Acid SCHEMBL28136110 0.91 ALDH1A1 (0.44) ALDH1A1TP53LMNAMAPK1
SCHEMBL27572585 0.90
Hydrochloric Acid SCHEMBL27484358 0.90
Methane SCHEMBL28312214 0.90
Nitric Acid SCHEMBL5696204 0.87 CA5A (0.42) ALDH1A1TP53LMNAMAPK1
Potassium Ion SCHEMBL28442945 0.87 ALDH1A1 (0.39) ALDH1A1TP53LMNAMAPK1
Ethylene SCHEMBL7111339 0.87
Methylamine SCHEMBL28188163 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
CN-105762366-A Composite current collector of lithium ion battery and manufacturing method of composite current collector 江苏深苏电子科技有限公司 2016-07-13 CN disclosed