Bicarbonate

Bicarbonate

SCHEMBL28863262

CC1=CC(=O)CC(C)(C)C1.N.N.O=C(O)O

nearest known ligand 0.45

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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 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.45
KMT2A Q03164 4/20 0.45
ALDH1A1 P00352 3/20 0.45
MAPT P10636 3/20 0.45
KDM4E B2RXH2 2/20 0.44
LMNA P02545 3/20 0.44
GAA P10253 3/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 2/20 0.41
APEX1 P27695 1/20 0.39
POLB P06746 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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 SCHEMBL15652769 0.98 HPGD (0.46) HPGDKMT2AALDH1A1MAPTKDM4E
Bicarbonate SCHEMBL29832424 0.98 HPGD (0.46) HPGDKMT2AALDH1A1MAPTKDM4E
Carbamic Acid SCHEMBL11339972 0.92 HPGD (0.43) HPGDKMT2AALDH1A1MAPTKDM4E
Acetic Acid SCHEMBL31758441 0.92 HPGD (0.45) HPGDKMT2AALDH1A1MAPTKDM4E
Acetic Acid SCHEMBL28619942 0.92 HPGD (0.45) HPGDKMT2AALDH1A1MAPTKDM4E
Ammonia Solution, Strong SCHEMBL7735826 0.92 ALDH1A1 (0.50) HPGDKMT2AALDH1A1MAPTKDM4E
Carbamic Acid SCHEMBL8982281 0.90 HPGD (0.44) HPGDKMT2AALDH1A1MAPTKDM4E
Hydrochloric Acid SCHEMBL9228549 0.90 ALDH1A1 (0.48) HPGDKMT2AALDH1A1MAPTKDM4E
Methyl Alcohol SCHEMBL9328801 0.90 ALDH1A1 (0.48) HPGDKMT2AALDH1A1MAPTKDM4E
SCHEMBL7102666 0.89 ALDH1A1 (0.52) HPGDKMT2AALDH1A1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115197460-B Preparation method of easily degradable epoxy foam with self-repairing and shape memory effects 中国林业科学研究院林产化学工业研究所 2024-03-15 CN disclosed
CN-115197460-A Preparation method of easily degradable epoxy foam with self-repairing and shape memory effects 中国林业科学研究院林产化学工业研究所 2022-10-18 CN disclosed