Gluconic Acid

Gluconic Acid

SCHEMBL4702202

O=C(O)CCC(=O)O.O=C(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.83

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9A

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 19)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.83
LMNA P02545 3/20 0.57
USP2 O75604 1/20 0.52
SLCO1B1 Q9Y6L6 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.48
TDP1 Q9NUW8 1/20 0.46
TSHR P16473 2/20 0.45
CYP2C9 P11712 1/20 0.45
ALKBH5 Q6P6C2 1/20 0.39
SUCNR1 Q9BXA5 1/20 0.39
EGLN1 Q9GZT9 1/20 0.39
TET2 Q6N021 3/20 0.38
KDM4A O75164 2/20 0.38
KDM4C Q9H3R0 2/20 0.38
KDM2A Q9Y2K7 2/20 0.38
TET3 O43151 1/20 0.38
OR51E2 Q9H255 1/20 0.37
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35

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
Gluconic Acid SCHEMBL13056936 0.91 PDE4A (1.00) PDE4ALMNAUSP2SLCO1B1L3MBTL1
Mucic Acid SCHEMBL17164506 0.91 PDE4A (1.00) PDE4ALMNAUSP2SLCO1B1L3MBTL1
Gluconic Acid SCHEMBL15339348 0.91 PDE4A (1.00) PDE4ALMNAUSP2SLCO1B1L3MBTL1
Gluconic Acid SCHEMBL8462892 0.91 PDE4A (1.00) PDE4ALMNAUSP2SLCO1B1L3MBTL1
Gluconic Acid SCHEMBL193661 0.91 PDE4A (1.00) PDE4ALMNAUSP2SLCO1B1L3MBTL1
Gluconic Acid SCHEMBL19257183 0.91 PDE4A (1.00) PDE4ALMNAUSP2SLCO1B1L3MBTL1
Gluconic Acid SCHEMBL14617612 0.91 PDE4A (1.00) PDE4ALMNAUSP2SLCO1B1L3MBTL1
Gluconic Acid SCHEMBL16609838 0.91 PDE4A (1.00) PDE4ALMNAUSP2SLCO1B1L3MBTL1
Gluconic Acid SCHEMBL21778048 0.91 PDE4A (1.00) PDE4ALMNAUSP2SLCO1B1L3MBTL1
Gluconic Acid SCHEMBL16592174 0.91 PDE4A (1.00) PDE4ALMNAUSP2SLCO1B1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2001984-A1 CLEANING SOLUTIONS INCLUDING PRESERVATIVE COMPOUNDS FOR POST CMP CLEANING PROCESSES L'AIR LIQUIDE, Société Anonyme pour l'Etude et l'Exploitation des Procédés Georges Claude (FR) 2008-12-17 EP claimed
WO-2007110720-A1 CLEANING SOLUTIONS INCLUDING PRESERVATIVE COMPOUNDS FOR POST CMP CLEANING PROCESSES L'AIR LIQUIE-SOCIETE ANONYME POUR L'ETUDE ET L'EXPLOITATION DES PRECEDES GEORGES CLAUDE (US) 2007-10-04 WO claimed
US-20070232511-A1 Cleaning solutions including preservative compounds for post CMP cleaning processes FISHER MATTHEW 2007-10-04 US claimed
US-4362710-A Feeds for baby pigs, process for preparing the same and method of breeding baby pigs NISSAN GOSEI KOGYO CO., LTD. (JP) 1982-12-07 US claimed
EP-2001984-A1 CLEANING SOLUTIONS INCLUDING PRESERVATIVE COMPOUNDS FOR POST CMP CLEANING PROCESSES L'AIR LIQUIDE, Société Anonyme pour l'Etude et l'Exploitation des Procédés Georges Claude (FR) 2008-12-17 EP disclosed
WO-2007110720-A1 CLEANING SOLUTIONS INCLUDING PRESERVATIVE COMPOUNDS FOR POST CMP CLEANING PROCESSES L'AIR LIQUIE-SOCIETE ANONYME POUR L'ETUDE ET L'EXPLOITATION DES PRECEDES GEORGES CLAUDE (US) 2007-10-04 WO disclosed
US-20070232511-A1 Cleaning solutions including preservative compounds for post CMP cleaning processes FISHER MATTHEW 2007-10-04 US disclosed