Acetic Acid

Acetic Acid

SCHEMBL1305656

CC(=O)O.CC(=O)[O-].CC[n+]1ccn(C)c1C

nearest known ligand 0.32

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 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
MEN1 O00255 1/20 0.30
EEF2K O00418 1/20 0.30
PLK4 O00444 1/20 0.30
JAK2 O60674 1/20 0.30
EGFR P00533 1/20 0.30
EEF2 P13639 1/20 0.30
TYK2 P29597 1/20 0.30
FLT3 P36888 1/20 0.30
BLM P54132 1/20 0.30
KMT2A Q03164 1/20 0.30
ITK Q08881 1/20 0.30
PIM2 Q9P1W9 1/20 0.30

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 SCHEMBL1223457 0.97 CA1 (0.33) CA1CA2
Bicarbonate SCHEMBL28771598 0.93 CA1 (0.33) CA1CA2MEN1EEF2KPLK4
Acetic Acid SCHEMBL28811876 0.85 CA1 (0.39) CA1CA2MEN1EEF2KPLK4
Acetic Acid SCHEMBL15392706 0.82 CA1 (0.47) CA1CA2MEN1EEF2KPLK4
Bromide SCHEMBL710393 0.82 CA1 (0.39) CA1CA2MEN1EEF2KPLK4
Phthalic Acid SCHEMBL21378208 0.81 ALDH1A1 (0.35) CA1CA2MEN1EEF2KPLK4
Sulfuric Acid SCHEMBL17102575 0.81 CA1 (0.33) CA1CA2
Phosphoric Acid SCHEMBL25379987 0.81 CTDSP1 (0.37) CA1CA2MEN1EEF2KPLK4
Acetic Acid SCHEMBL2788542 0.80 CA1 (0.55) CA1CA2MEN1EEF2KPLK4
Phthalic Acid SCHEMBL28390383 0.80 ALDH1A1 (0.42) CA1CA2MEN1EEF2KPLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2158248-B1 CATALYST FOR CURING EPOXIDES BASF SE (DE) 2012-08-15 EP claimed
US-8053546-B2 Catalyst for curing epoxides BASF SE (DE) 2011-11-08 US claimed
US-20100187715-A1 CATALYST FOR CURING EPOXIDES BASF SE (DE) 2010-07-29 US claimed
EP-0458502-B1 Latent catalysts, cure-inhibited epoxy resin compositions and laminates prepared therefrom DOW GLOBAL TECHNOLOGIES INC (US) 2003-06-18 EP claimed
US-5169473-A Complex of an onium, arsenic or amine compound and boric acid; advanced polyepoxides; storage stability THE DOW CHEMICAL COMPANY (US) 1992-12-08 US claimed
EP-0458502-A2 Latent catalysts, cure-inhibited epoxy resin compositions and laminates prepared therefrom THE DOW CHEMICAL COMPANY (US) 1991-11-27 EP claimed
US-20120259044-A1 HYPERBRANCHED POLYMERS FOR MODIFYING THE TOUGHNESS OF ANIONICALLY CURED EPOXY RESIN SYSTEMS BASF SE (DE) 2012-10-11 US disclosed
US-8247517-B2 Catalyst for curing epoxides BASF SE (DE) 2012-08-21 US disclosed
US-8202580-B2 Catalyst for curing epoxides BASF SE (DE) 2012-06-19 US disclosed
US-8193297-B2 Catalyst for curing epoxides BASF SE (DE) 2012-06-05 US disclosed
US-8053546-B2 Catalyst for curing epoxides BASF SE (DE) 2011-11-08 US disclosed
US-8053546-B2 Catalyst for curing epoxides BASF SE (DE) 2011-11-08 US disclosed
US-20100187715-A1 CATALYST FOR CURING EPOXIDES BASF SE (DE) 2010-07-29 US disclosed
US-5342865-A Solvent system THE DOW CHEMICAL COMPANY (US) 1994-08-30 US disclosed
EP-0567248-A1 Solvent system THE DOW CHEMICAL COMPANY (US) 1993-10-27 EP disclosed
EP-0553887-A2 Catalysts and epoxy resin composition containing the same THE DOW CHEMICAL COMPANY (US) 1993-08-04 EP disclosed
US-5169473-A Complex of an onium, arsenic or amine compound and boric acid; advanced polyepoxides; storage stability THE DOW CHEMICAL COMPANY (US) 1992-12-08 US disclosed
EP-0458502-A2 Latent catalysts, cure-inhibited epoxy resin compositions and laminates prepared therefrom THE DOW CHEMICAL COMPANY (US) 1991-11-27 EP disclosed
US-4925901-A STORAGE STAABILITY, ONIUM ION CATALYST THE DOW CHEMICAL COMPANY (US) 1990-05-15 US disclosed
EP-0328020-A2 Use of a catalyst in epoxy compositions THE DOW CHEMICAL COMPANY (US) 1989-08-16 EP disclosed