Acetic Acid

Acetic Acid

SCHEMBL2129191

CC(=O)O.Cc1cccc(C(C)(C)N)c1C

nearest known ligand 0.42

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
TRPA1 O75762 2/20 0.42
ATM Q13315 1/20 0.42
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
MYC P01106 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
AKR1B10 O60218 1/20 0.37
ABCB11 O95342 1/20 0.37
DHFR P00374 1/20 0.37
LMNA P02545 1/20 0.37
MPO P05164 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CHRM1 P11229 1/20 0.37
CYP2C9 P11712 1/20 0.37
AKR1B1 P15121 1/20 0.37
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
AKR1C3 P42330 1/20 0.37

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
SCHEMBL3638609 0.88 TRPA1 (0.46) TRPA1ATMGABRA1GABRB2MEN1
Hydrochloric Acid SCHEMBL2965181 0.86 TRPA1 (0.44) TRPA1ATMGABRA1GABRB2MEN1
Water SCHEMBL10401166 0.86 TRPA1 (0.44) TRPA1ATMGABRA1GABRB2MEN1
Acetic Acid SCHEMBL1047016 0.85 HPGD (0.40) ATMGABRA1GABRB2MYCMEN1
Bicarbonate SCHEMBL5874331 0.79 KMT2A (0.41) ATMGABRA1GABRB2MYCMEN1
Acetic Acid SCHEMBL988127 0.78 SLC9A1 (0.35)
Acetic Acid SCHEMBL30560723 0.77 TRPA1 (0.52) TRPA1ATMMYCMEN1KMT2A
Acetic Acid SCHEMBL3662435 0.77 TRPA1 (0.52) TRPA1ATMMYCMEN1KMT2A
Oxalic Acid SCHEMBL5179301 0.77 ALDH1A1 (0.44) ATMGABRA1GABRB2MYCKMT2A
Oxalic Acid SCHEMBL153610 0.77 ALDH1A1 (0.44) ATMGABRA1GABRB2MYCKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1037951-B1 PHOTOCHROMIC EPOXY RESIN COATING COMPOSITION PPG IND OHIO INC (US) 2005-11-16 EP claimed
US-6268055-B1 CURED OVERCOATING PPG INDUSTRIES OHIO, INC. 2001-07-31 US claimed
EP-1037951-A1 PHOTOCHROMIC EPOXY RESIN COATING COMPOSITION PPG Industries Ohio, Inc. (US) 2000-09-27 EP claimed
WO-1999029791-A1 PHOTOCHROMIC EPOXY RESIN COATING COMPOSITION PPG INDUSTRIES OHIO, INC. (US) 1999-06-17 WO claimed
US-20240318031-A1 WATERBORNE ACID-EPOXY COATING COMPOSITION PPG INDUSTRIES OHIO, INC. (US) 2024-09-26 US disclosed
EP-4271723-A1 WATERBORNE ACID-EPOXY COATING COMPOSITION PPG Industries Ohio Inc. (US) 2023-11-08 EP disclosed
CN-116940614-A Aqueous acid-epoxy resin coating composition PPG工业俄亥俄公司 2023-10-24 CN disclosed
WO-2022147082-A1 WATERBORNE ACID-EPOXY COATING COMPOSITION PPG INDUSTRIES OHIO, INC. (US) 2022-07-07 WO disclosed
EP-1952184-B1 PHOTOCHROMIC MULTIFOCAL OPTICAL ARTICLE TRANSITIONS OPTICAL INC (US) 2021-08-11 EP disclosed
US-8742012-B2 Thermosetting film-forming compositions that produce atrane-containing cured coatings PPG INDUSTRIES OHIO, INC. (US) 2014-06-03 US disclosed
WO-2014043434-A2 POLYEPOXIDE-POLYACID COATING COMPOSITIONS, RELATED COATING PROCESSES AND COATED SUBSTRATES PPG INDUSTRIES OHIO, INC. (US) 2014-03-20 WO disclosed
US-20140072716-A1 POLYEPOXIDE-POLYACID COATING COMPOSITIONS, RELATED COATING PROCESSES AND COATED SUBSTRATES PPG INDUSTRIES OHIO, INC. (US) 2014-03-13 US disclosed
EP-0305078-A2 Process for preparing colour-plus-clear coated articles using high solids coating compositions containing a polyepoxide and a copolymer of an alpha-olefin and an olefinically unsaturated monoanhydride PPG INDUSTRIES, INC. (US) 1989-03-01 EP disclosed
US-4764430-A Crosslinkable compositions containing polyepoxides and polyacid curing agents PPG INDUSTRIES, INC. (US) 1988-08-16 US disclosed
EP-0275138-A2 Crosslinkable compositions containing polyepoxides and polyacid curing agents PPG INDUSTRIES, INC. (US) 1988-07-20 EP disclosed
US-4737403-A PRIMER COMPRISING EPOXIDE-CONTAINING POLYMER AND POLYACID CURING AGENT PPG INDUSTRIES, INC. (US) 1988-04-12 US disclosed
US-4703101-A COATINGS PPG INDUSTRIES, INC. (US) 1987-10-27 US disclosed
US-4681811-A AUTOMOTIVE TOP COAT PPG INDUSTRIES, INC. (US) 1987-07-21 US disclosed
US-4650718-A AUTOMOBILE FINISHES PPG INDUSTRIES, INC. (US) 1987-03-17 US disclosed
EP-0212457-A2 Color plus clear coatings employing polyepoxides and polyacid curing agents in the clear coat PPG INDUSTRIES, INC. (US) 1987-03-04 EP disclosed