Gluconic Acid

Gluconic Acid

SCHEMBL28813672

O=C([O-])C(O)C(O)C(O)C(O)CO.O=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-].[Mg+2].[Mg+2]

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHESCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9A

The experimentally established mechanism targets of Gluconic Acid. 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
LMNA P02545 2/20 0.62
CA4 P22748 1/20 0.50
PDE4A P27815 1/20 0.47
USP2 O75604 1/20 0.37
SLCO1B1 Q9Y6L6 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.35
TDP1 Q9NUW8 1/20 0.34

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
Citric Acid SCHEMBL8731625 1.00 LMNA (0.62) LMNACA4PDE4AUSP2SLCO1B1
Citric Acid SCHEMBL8578020 0.98 LMNA (0.66) LMNACA4PDE4AUSP2SLCO1B1
Citric Acid SCHEMBL10438269 0.98 LMNA (0.65) LMNACA4PDE4AUSP2SLCO1B1
Gluconic Acid SCHEMBL21198846 0.97 LMNA (0.59) LMNACA4PDE4AUSP2SLCO1B1
Gluconic Acid SCHEMBL28153403 0.97 LMNA (0.62) LMNACA4PDE4AUSP2SLCO1B1
Citric Acid SCHEMBL301966 0.97 LMNA (0.62) LMNACA4PDE4AUSP2SLCO1B1
Citric Acid SCHEMBL17965941 0.97 LMNA (0.62) LMNACA4PDE4AUSP2SLCO1B1
Gluconic Acid SCHEMBL20906377 0.97 LMNA (0.62) LMNACA4PDE4AUSP2SLCO1B1
Citric Acid SCHEMBL8160075 0.97 LMNA (0.62) LMNACA4PDE4AUSP2SLCO1B1
Citric Acid SCHEMBL4630716 0.95 LMNA (0.61) LMNACA4PDE4AUSP2SLCO1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107412217-A Magnesium compositions and application thereof 纽罗森特里亚股份有限公司 2017-12-01 CN disclosed
CN-104161744-B Magnesium compositions and uses thereof 纽罗森特里亚股份有限公司 2017-04-12 CN disclosed
CN-104161744-A Magnesium compositions and uses thereof MAGCEUTICS INC 2014-11-26 CN disclosed
CN-101742998-B Magnesium composition and use thereof MAGCEUTICS INC 2014-09-17 CN disclosed