Acetic Acid

Acetic Acid

SCHEMBL234816

CC(=O)O.CC(=O)O.CC(=O)O.O

nearest known ligand 0.88

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.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 2/20 0.88
LCK P06239 1/20 0.88
FYN P06241 1/20 0.88
LMNA P02545 4/20 0.56
TSHR P16473 2/20 0.50
THPO P40225 1/20 0.50
CA1 P00915 3/20 0.46
ALOX15 P16050 1/20 0.46
BLM P54132 1/20 0.46
PMP22 Q01453 1/20 0.46
CA2 P00918 2/20 0.44
CA9 Q16790 1/20 0.44
ALDH1A1 P00352 4/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 1/20 0.39
PTGS1 P23219 1/20 0.39
MMP12 P39900 1/20 0.39
CA4 P22748 1/20 0.39
SLC15A2 Q16348 1/20 0.38
ACHE P22303 1/20 0.36

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 SCHEMBL5867869 1.00 FFAR3 (0.88) FFAR3LCKFYNLMNATSHR
Acetic Acid SCHEMBL11858088 1.00 FFAR3 (0.88) FFAR3LCKFYNLMNATSHR
Acetic Acid SCHEMBL536985 1.00
Acetic Acid SCHEMBL11857925 1.00 FFAR3 (0.88) FFAR3LCKFYNLMNATSHR
Acetic Acid SCHEMBL226015 1.00
Acetic Acid SCHEMBL52435 1.00
Acetic Acid SCHEMBL4124082 1.00
Acetic Acid SCHEMBL51762 1.00
Acetic Acid SCHEMBL5573359 1.00 FFAR3 (0.88) FFAR3LCKFYNLMNATSHR
Acetic Acid SCHEMBL11776704 1.00 FFAR3 (0.88) FFAR3LCKFYNLMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0945496-B1 Ink compositions and multicolor thermal ink jet printing process for the production of high quality images XEROX CORP (US) 2003-11-12 EP claimed
EP-0945496-A1 Ink compositions and multicolor thermal ink jet printing process for the production of high quality images Xerox Corporation (US) 1999-09-29 EP claimed
US-5958121-A SET OF INKS COMPRISING FIRST AQUEOUS INK CONSISTING OF ANIONIC COLORANT, SECOND AQUEOUS INK CONTAINING AMMONIUM SALT, WHEREIN FIRST COLORANT IS IMMOBILIZED ON SUBSTRATE BY INTERACTION WITH AMMONIUM SALT, REDUCING INTERCOLOR BLEED XEROX CORPORATION (US) 1999-09-28 US claimed
US-4839465-A SUBSTANCE P ANTAGONIST, HYPOTENSIVE AGENT, ANALGESICS STERLING DRUG INC. (US) 1989-06-13 US claimed
CN-114597512-A Preparation method of high-specific-energy Zn/AgO small button secondary battery 武汉船用电力推进装置研究所(中国船舶重工集团公司第七一二研究所) 2022-06-07 CN disclosed
CN-107667096-A Novel Gadolinium Chelate Compounds for Magnetic Resonance Imaging 拜耳医药股份公司 2018-02-06 CN disclosed
EP-1674444-B9 METHOD FOR PRODUCING ESTER CONDENSED PRODUCT JAPAN SCIENCE & TECH AGENCY (JP) 2013-11-20 EP disclosed
EP-1674444-B1 METHOD FOR PRODUCING ESTER CONDENSED PRODUCT JAPAN SCIENCE & TECH AGENCY (JP) 2013-07-17 EP disclosed
US-20120003386-A1 METHOD FOR PRODUCING AMORPHOUS METAL ORGANIC MACROMOLECULES, MATERIAL OBTAINED BY SAID METHOD, AND USE THEREOF FRAUNHOFER-GESELLSCHAFT FÖRDERUNG DER ANGEWANDTEN FORSCHUNG E.V. (DE) 2012-01-05 US disclosed
US-7973193-B2 Method for producing ester condensed product JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2011-07-05 US disclosed
US-20090187042-A1 METHOD FOR PRODUCING ESTER CONDENSED PRODUCT JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2009-07-23 US disclosed
US-20070004936-A1 Method for producing ester condensed product JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2007-01-04 US disclosed
EP-1674444-A1 METHOD FOR PRODUCING ESTER CONDENSED PRODUCT Japan Science and Technology Agency (JP) 2006-06-28 EP disclosed
EP-0945496-B1 Ink compositions and multicolor thermal ink jet printing process for the production of high quality images XEROX CORP (US) 2003-11-12 EP disclosed
EP-0945496-A1 Ink compositions and multicolor thermal ink jet printing process for the production of high quality images Xerox Corporation (US) 1999-09-29 EP disclosed
US-5958121-A SET OF INKS COMPRISING FIRST AQUEOUS INK CONSISTING OF ANIONIC COLORANT, SECOND AQUEOUS INK CONTAINING AMMONIUM SALT, WHEREIN FIRST COLORANT IS IMMOBILIZED ON SUBSTRATE BY INTERACTION WITH AMMONIUM SALT, REDUCING INTERCOLOR BLEED XEROX CORPORATION (US) 1999-09-28 US disclosed
US-5034550-A Reaction of heavy metal tetraalkoxide and heavy metal tricarboxylate, distillation to purify AKZO N.V. (NL) 1991-07-23 US disclosed
US-4839465-A SUBSTANCE P ANTAGONIST, HYPOTENSIVE AGENT, ANALGESICS STERLING DRUG INC. (US) 1989-06-13 US disclosed