Bicarbonate

Bicarbonate

SCHEMBL5032085

CCCCn1cc[n+](C)c1.CCCCn1cc[n+](C)c1.O=C([O-])[O-]

nearest known ligand 0.79

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 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.67
MEN1 O00255 2/20 0.67
HSP90AA1 P07900 2/20 0.67
KMT2A Q03164 2/20 0.67
APAF1 O14727 1/20 0.67
NPC1 O15118 1/20 0.67
PLA2G1B P04054 1/20 0.67
MAPT P10636 1/20 0.67
MAPK1 P28482 1/20 0.67
HTT P42858 1/20 0.67
RAB9A P51151 1/20 0.67
NPSR1 Q6W5P4 1/20 0.67
ATG4B Q9Y4P1 1/20 0.67
FDPS P14324 16/20 0.46
LMNA P02545 1/20 0.40

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
Acetic Acid SCHEMBL35016 0.95 MEN1 (0.65) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Bicarbonate SCHEMBL2127082 0.95 MEN1 (0.65) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Propionic Acid SCHEMBL358644 0.93 MEN1 (0.63) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Glycolic Acid SCHEMBL18575076 0.93 MEN1 (0.63) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Bicarbonate SCHEMBL23698461 0.92 MEN1 (0.76) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Bicarbonate SCHEMBL23698459 0.92 MEN1 (0.76) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Succinic Acid SCHEMBL18575092 0.92 MEN1 (0.61) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Bicarbonate SCHEMBL28424269 0.91 SMN1; SMN2 (0.69) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Butyric Acid SCHEMBL507693 0.91 MEN1 (0.59) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1
Pivalate SCHEMBL18575129 0.91 MEN1 (0.59) SMN1; SMN2MEN1HSP90AA1KMT2AAPAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114317027-A Method for separating naphthenic acid from naphthenic acid-containing oil product by using ionic liquid 中国石油大学(北京) 2022-04-12 CN claimed
CN-114317027-B Method for separating naphthenic acid from naphthenic acid-containing oil product by using ionic liquid 中国石油大学(北京) 2023-04-07 CN disclosed
CN-115611736-A Synthetic method of high hindered phenol antioxidant 1010 濮阳市中原石化实业有限公司 2023-01-17 CN disclosed
CN-114317027-A Method for separating naphthenic acid from naphthenic acid-containing oil product by using ionic liquid 中国石油大学(北京) 2022-04-12 CN disclosed
CN-113620787-A Synthetic method of fluorine-containing aromatic ether 浙江诺亚氟化工有限公司 2021-11-09 CN disclosed
CN-111807934-B Preparation method of electronic-grade propylene glycol monomethyl ether and product obtained by preparation method 山东海科创新研究院有限公司 2021-02-26 CN disclosed
CN-111807934-A Preparation method of electronic-grade propylene glycol monomethyl ether and product obtained by preparation method 山东海科创新研究院有限公司 2020-10-23 CN disclosed
US-9862675-B1 Method of N-formylating amines with a phosphonic anhydride KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2018-01-09 US disclosed
EP-1658262-B1 METHOD FOR PRODUCING IONIC LIQUIDS, IONIC SOLIDS OR MIXTURES THEREOF PROIONIC PRODUCTION OF IONIC SUBSTANCES GMBH & CO KG (AT) 2013-02-20 EP disclosed
US-8075803-B2 Metathesis of a a quaternary ammonium, phosphonium or sulfonium cation forming a salt of hydrogencarbonate, carbonate, monoalkylcarbonate or monoarylcarbonate; storage stablility PROIONIC GMBH (AT) 2011-12-13 US disclosed
US-20080251759-A1 Method For Producing Ionic Liquids, Ionic Solids Or Mixtures Thereof PROIONIC GMBH (AT) 2008-10-16 US disclosed
EP-1658262-A2 METHOD FOR PRODUCING IONIC LIQUIDS, IONIC SOLIDS OR MIXTURES THEREOF Proionic Production of Ionic Substances GmbH & Co KEG (AT) 2006-05-24 EP disclosed
WO-2006027069-A1 METHOD FOR PRODUCING HETEROCYCLIC QUATERNARY AMMONIUM AND/OR GUANIDINIUM COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2006-03-16 WO disclosed
WO-2005021484-A2 METHOD FOR PRODUCING IONIC LIQUIDS, IONIC SOLIDS OR MIXTURES THEREOF PROIONIC PRODUCTION OF IONIC SUBSTANCES GMBH & CO KEG (AT) 2005-03-10 WO disclosed