Acetic Acid

Acetic Acid

SCHEMBL459122

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

nearest known ligand 0.40

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 0.35
LCK P06239 1/20 0.35
FYN P06241 1/20 0.35
ALDH1A1 P00352 3/20 0.35
TSHR P16473 2/20 0.35
SLC6A3 Q01959 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
CHRM1 P11229 1/20 0.33
AKR1A1 P14550 1/20 0.33
CHRM3 P20309 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
ADRA1A P35348 1/20 0.33
HRH1 P35367 1/20 0.33
DRD3 P35462 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
CA2 P00918 1/20 0.33
MAPK1 P28482 1/20 0.33
GRIK1 P39086 3/20 0.32

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
SCHEMBL14533808 0.95
SCHEMBL26620 0.95
Ethylene SCHEMBL3936195 0.92 TSHR (0.36) FFAR3ALDH1A1TSHRSLC6A3TDP1
SCHEMBL10345897 0.84 CA2 (0.34) ALDH1A1TSHRSLC6A3TDP1CHRM1
SCHEMBL3751305 0.82 CYP2D6 (0.33) FFAR3ALDH1A1TSHRSLC6A3SLC6A2
SCHEMBL2017228 0.79
SCHEMBL4441348 0.79 TSHR (0.38) ALDH1A1TSHRSLC6A3SLC6A2SLC6A4
SCHEMBL323329 0.78
SCHEMBL29957730 0.78
SCHEMBL9276921 0.78 ALDH1A1 (0.40) ALDH1A1TSHRSLC6A3TDP1GRIK1

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 466 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2968195-B1 PHARMACEUTICAL FORMULATION CONTAINING GLYCOSAMINOGLYCAN AIHOL CORP (US) 2020-08-19 EP claimed
WO-2019064090-A1 NOVEL PHARMACEUTICAL COMPOSITION COMPRISING MEFENAMIC ACID AND OTHER ANALGESIC ZENVISION PHARMA LLP (IN) 2019-04-04 WO claimed
US-10220042-B2 Modified release preparations containing oxcarbazepine and derivatives thereof SUPERNUS PHARMACEUTICALS, INC. (US) 2019-03-05 US claimed
US-20180098996-A1 MODIFIED RELEASE PREPARATIONS CONTAINING OXCARBAZEPINE AND DERIVATIVES THEREOF SUPERNUS PHARMACEUTICALS, INC. (US) 2018-04-12 US claimed
US-9855278-B2 Modified release preparations containing oxcarbazepine and derivatives thereof SUPERNUS PHARMACEUTICALS, INC. (US) 2018-01-02 US claimed
US-20170056411-A1 MODIFIED RELEASE PREPARATIONS CONTAINING OXCARBAZEPINE AND DERIVATIVES THEREOF SUPERNUS PHARMACEUTICALS, INC. (US) 2017-03-02 US claimed
US-9539265-B2 Pharmaceutical formulation containing glycosaminoglycan AIHOL CORPORATION (US) 2017-01-10 US claimed
US-9370525-B2 Modified release preparations containing oxcarbazepine and derivatives thereof SUPERNUS PHARMACEUTICALS, INC. (US) 2016-06-21 US claimed
US-9351975-B2 Modified release preparations containing oxcarbazepine and derivatives thereof SUPERNUS PHARMACEUTICALS, INC. (US) 2016-05-31 US claimed
EP-2968195-A1 PHARMACEUTICAL FORMULATION CONTAINING GLYCOSAMINOGLYCAN Aihol Corporation (US) 2016-01-20 EP claimed
WO-2007127630-A1 CONTROLLED RELEASED PREPARATIONS OF OXCARBAZEPINE HAVING SIGMOIDAL RELEASE PROFILE SUPERNUS PHARMACEUTICALS, INC (US) 2007-11-08 WO claimed
US-20070254033-A1 comprise solubility-and/or release enhancing agents to provide tailored drug release profiles, preferably sigmoidal release profiles; controlled-release preparations of oxcarbazepine and derivatives thereof for once-a-day administration SUPERNUS PHARMACEUTICALS, INC. 2007-11-01 US claimed
US-20050106233-A1 Seamless; high oil content; formed by emulsion comprising oil, water, emulsifier (polyoxyethylene glycol-sorbitan monolaurate), water-soluble monovalent/polyvalent metal salt (calcium chloride), and acid; marmelo mucilage free; gelation FMC BIOPOLYMERS AS (NO) 2005-05-19 US claimed
EP-1496871-A1 POLYSACCHARIDE CAPSULES AND METHODS OF PREPARATION FMC Biopolymer AS (NO) 2005-01-19 EP claimed
US-6838094-B2 Tablet containing a coated core SMITHKLINE BEECHAM P.L.C. (GB) 2005-01-04 US claimed
WO-2003084516-A1 POLYSACCHARIDE CAPSULES AND METHODS OF PREPARATION FMC BIOPOLYMER AS (NO) 2003-10-16 WO claimed
US-20030118640-A1 Pharmaceutical formulations comprising sodium amoxycillin and potassium clavulanate SMITHKLINE BEECHAM P.L.C. (GB) 2003-06-26 US claimed
EP-1239841-A1 PHARMACEUTICAL FORMULATIONS COMPRISING SODIUM AMOXYCILLINE AND POTASSIUM CLAVULANATE SmithKline Beecham plc (GB) 2002-09-18 EP claimed
US-6358528-B1 FOR THERAPY OF BACTERIAL INFECTION, SUSTAINED RELEASE SMITHKLINE BEECHAM P.L.C. (GB) 2002-03-19 US claimed
WO-2001047499-A1 PHARMACEUTICAL FORMULATIONS COMPRISING SODIUM AMOXYCILLIN AND POTASSIUM CLAVULANATE SMITHKLINE BEECHAM P.L.C. (GB) 2001-07-05 WO claimed