Acetic Acid

Acetic Acid

SCHEMBL2112596

CC(=O)O.CC(=O)O.CC(=O)O.CCCN(CCN)[Si](OC)(OC)OC.[NaH].[NaH].[NaH]

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Acetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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 SCHEMBL4394142 0.98
Acetic Acid SCHEMBL1516463 0.98
SCHEMBL231393 0.87
SCHEMBL11804302 0.70
SCHEMBL11500860 0.70
SCHEMBL16389750 0.68
Bromide SCHEMBL3626984 0.67 DNM1 (0.31)
SCHEMBL7053324 0.66
Acetic Acid SCHEMBL1953723 0.66 CA12 (0.32)
SCHEMBL1810891 0.66 CA12 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1838173-A2 METHOD OF PREVENTING OR REDUCING OFF-FLAVOR IN A BEVERAGE USING SILANE-TREATED SILICA FILTER MEDIA DOW CORNING CORPORATION (US) 2007-10-03 EP claimed
WO-2006065556-A2 METHOD OF PREVENTING OR REDUCING OFF-FLAVOR IN A BEVERAGE USING SILANE-TREATED SILICA FILTER MEDIA DOW CORNING CORPORATION (US) 2006-06-22 WO claimed
CN-109971790-B Near-infrared light regulation gene editing method 南京大学 2022-06-10 CN disclosed
US-8158301-B2 Polyelectrolyte membranes and methods for making GENERAL ELECTRIC COMPANY (US) 2012-04-17 US disclosed
US-20090297911-A1 POLYELECTROLYTE MEMBRANES AND METHODS FOR MAKING BHA ALTAIR, LLC 2009-12-03 US disclosed
EP-2128921-A1 Polyelectrolyte membranes and methods for making General Electric Company (US) 2009-12-02 EP disclosed