Acetic Acid

Acetic Acid

SCHEMBL5844598

CC(=O)[O-].CC[N+](C)(C)CC

nearest known ligand 0.52

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
BBOX1 O75936 6/20 0.52
CA1 P00915 2/20 0.50
CA4 P22748 2/20 0.37
ALDH1A1 P00352 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
FFAR3 O14843 2/20 0.36
HDAC3 O15379 2/20 0.36
HDAC1 Q13547 2/20 0.36
HDAC2 Q92769 2/20 0.36
HDAC8 Q9BY41 2/20 0.36
CYP2C19 P33261 1/20 0.35
POLB P06746 1/20 0.33
BLM P54132 1/20 0.33
ATM Q13315 1/20 0.33

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
Bicarbonate SCHEMBL4444508 0.90 BBOX1 (0.54) BBOX1CA1FFAR3HDAC3HDAC1
Oxalic Acid SCHEMBL30381501 0.88 BBOX1 (0.52) BBOX1CA1CA4FFAR3HDAC3
Bicarbonate SCHEMBL4444511 0.88 BBOX1 (0.52) BBOX1CA1ALDH1A1FFAR3HDAC3
Bicarbonate SCHEMBL9003366 0.88 BBOX1 (0.52) BBOX1CA1FFAR3HDAC3HDAC1
Oxalic Acid SCHEMBL1051688 0.88 BBOX1 (0.52) BBOX1CA1CA4FFAR3HDAC3
Propionic Acid SCHEMBL11436115 0.85 BBOX1 (0.56) BBOX1CA1ALDH1A1TDP1FFAR3
Acetic Acid SCHEMBL2531739 0.84 CA1 (0.53) BBOX1CA1CA4ALDH1A1TDP1
Methacrylic Acid SCHEMBL28377504 0.84 BBOX1 (0.45) BBOX1CA1CA4ALDH1A1TDP1
Oxalic Acid SCHEMBL1051691 0.82 BBOX1 (0.48) BBOX1CA4ALDH1A1FFAR3HDAC3
Acetic Acid SCHEMBL2761970 0.82 BBOX1 (0.54) BBOX1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0683163-B1 Process for producing glycidyl acrylate or glycidyl methacrylate MITSUBISHI GAS CHEMICAL CO (JP) 2000-03-01 EP claimed
US-5527927-A CATALYTIC TRANSESTERIFICATION OF GLYCIDOL AND METHYL METHACRYLATE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1996-06-18 US claimed
EP-0683163-A1 Process for producing glycidyl acrylate or glycidyl methacrylate MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1995-11-22 EP claimed
US-11282992-B2 Light-emitting module provided with semiconductor light-emitting element that emits deep ultraviolet light NATIONAL INSTITUTE OF INFORMATION AND COMMUNICATIONS TECHNOLOGY (JP) 2022-03-22 US disclosed
EP-3528297-B1 LIGHT-EMITTING MODULE PROVIDED WITH SEMICONDUCTOR LIGHT-EMITTING ELEMENT THAT EMITS DEEP ULTRAVIOLET LIGHT NAT INST INF & COMM TECH (JP) 2021-05-19 EP disclosed
US-20190288167-A1 LIGHT-EMITTING MODULE PROVIDED WITH SEMICONDUCTOR LIGHT-EMITTING ELEMENT THAT EMITS DEEP ULTRAVIOLET LIGHT NATIONAL INSTITUTE OF INFORMATION AND COMMUNICATIONS TECHNOLOGY (JP) 2019-09-19 US disclosed
EP-3528297-A1 LIGHT-EMITTING MODULE PROVIDED WITH SEMICONDUCTOR LIGHT-EMITTING ELEMENT THAT EMITS DEEP ULTRAVIOLET LIGHT National Institute of Information and Communications Technology (JP) 2019-08-21 EP disclosed
CN-110036493-A The luminescence component for having the semiconductor light-emitting elements of radiation deep ultraviolet light 国立研究开发法人情报通信研究机构 2019-07-19 CN disclosed
US-7125492-B2 Additives for reversed-phase HPLC mobile phases AGILENT TECHNOLOGIES, INC. (US) 2006-10-24 US disclosed
US-20050011836-A1 Additives for reversed-phase HPLC mobile phases AGILENT TECHNOLOGIES, INC. 2005-01-20 US disclosed
EP-0683163-B1 Process for producing glycidyl acrylate or glycidyl methacrylate MITSUBISHI GAS CHEMICAL CO (JP) 2000-03-01 EP disclosed
US-5527927-A CATALYTIC TRANSESTERIFICATION OF GLYCIDOL AND METHYL METHACRYLATE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1996-06-18 US disclosed
EP-0683163-A1 Process for producing glycidyl acrylate or glycidyl methacrylate MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1995-11-22 EP disclosed