Acetic Acid

Acetic Acid

SCHEMBL57505

CC(=O)[O-].CC(=O)[O-].[Pd+2].c1ccc(P(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.60

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
ESR1 known ✓ P03372 4/20 0.52
ESR2 known ✓ Q92731 4/20 0.52
CYP3A4 P08684 2/20 0.60
TDP1 Q9NUW8 2/20 0.60
CA2 P00918 1/20 0.42
CA4 P22748 1/20 0.42
CES2 O00748 3/20 0.41
CES1 P23141 3/20 0.41
CA1 P00915 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
GAA P10253 2/20 0.39
NAPRT Q6XQN6 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPT P10636 1/20 0.38
ALOX5 P09917 1/20 0.37
TSHR P16473 1/20 0.37
AKR1C3 P42330 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GLA P06280 1/20 0.37
NOTUM Q6P988 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
Acetic Acid SCHEMBL29287419 1.00 CYP3A4 (0.60) CYP3A4TDP1ESR1ESR2CA2
Acetic Acid SCHEMBL132767 1.00 CYP3A4 (0.60) CYP3A4TDP1ESR1ESR2CA2
Acetic Acid SCHEMBL366510 1.00 CYP3A4 (0.60) CYP3A4TDP1ESR1ESR2CA2
Acetic Acid SCHEMBL7752539 0.98 CYP3A4 (0.57) CYP3A4TDP1ESR1ESR2CA2
Acetic Acid SCHEMBL3302716 0.98 CYP3A4 (0.57) CYP3A4TDP1ESR1ESR2CA2
Acetic Acid SCHEMBL28591790 0.98 CYP3A4 (0.57) CYP3A4TDP1ESR1ESR2CA2
Acetic Acid SCHEMBL3826322 0.95 CYP3A4 (0.55) CYP3A4TDP1ESR1ESR2CA2
Acetic Acid SCHEMBL8422529 0.95 CYP3A4 (0.55) CYP3A4TDP1ESR1ESR2CA2
Acetic Acid SCHEMBL8425843 0.95 CYP3A4 (0.60) CYP3A4TDP1ESR1ESR2CA2
Acetic Acid SCHEMBL8693165 0.95 CYP3A4 (0.60) CYP3A4TDP1ESR1ESR2CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121574134-A Preparation method of treasipril and salt thereof 济南圣泉集团股份有限公司 2026-02-27 CN claimed
CN-120058707-A Preparation method of PARP inhibitor and intermediate thereof 湖北生物医药产业技术研究院有限公司 2025-05-30 CN claimed
CN-120037987-A Aryl phosphine oxide ligand copper-based catalyst, preparation method thereof and application thereof in hydrochlorination of acetylene 贵州重力科技环保股份有限公司 2025-05-27 CN claimed
CN-119912431-A Preparation method and control of Abeli impurity A 江苏天士力帝益药业有限公司 2025-05-02 CN claimed
CN-119490978-B Modified starch-based surfactant and preparation method and application thereof 佛山市益境环保科技有限公司温州分公司 2025-04-15 CN claimed
CN-119264184-B Preparation method of dideoxy ring-opened ribonucleotide triphosphate and intermediate 天津奥利芙生物技术有限公司 2025-03-28 CN claimed
CN-119708491-A Polydisulfide polymer material containing hydroxy ester group and preparation method thereof 衢州化工新材料创新研究院 2025-03-28 CN claimed
CN-119663360-A Supported catalyst for synthesizing dimethyl carbonate by electrocatalytic carbon dioxide, preparation method and application 北京理工大学深圳汽车研究院(电动车辆国家工程实验室深圳研究院) 2025-03-21 CN claimed
CN-119490978-A Modified starch-based surfactant and preparation method and application thereof 佛山市益境环保科技有限公司温州分公司 2025-02-21 CN claimed
WO-2025011547-A1 METHOD FOR OBTAINING ON-DNA AROMATIC COMPOUND VIA SUZUKI COUPLING REACTION AND USE THEREOF 晶泰智药技术(上海)有限公司 2025-01-16 WO claimed
CN-103951612-A Oxime ether acetate compound and preparation method and application thereof UNIV ZHEJIANG TECHNOLOGY 2014-07-30 CN claimed
CN-102951979-B Preparation method of 2-substitutional vinyl alcohol formate derivative UNIV TIANJIN 2014-07-09 CN claimed
CN-103910670-A Methoxy carbamate compound and preparation method and application thereof UNIV ZHEJIANG TECHNOLOGY 2014-07-09 CN claimed
CN-103768754-A Fire-extinguishment composition containing unsaturated hydrocarbon compounds and derivatives thereof XI AN JIAN RUI SAFETY EMERGENCY EQUIPMENT LTD LIABILITY COMPANY 2014-05-07 CN claimed
CN-102989508-A Synthesizing method and application of polymer microsphere immobilized palladium nanometer particles UNIV PEKING SHENZHEN GRAD SCHO 2013-03-27 CN claimed
CN-102951979-A Preparation method of 2-substitutional vinyl alcohol formate derivative UNIV TIANJIN 2013-03-06 CN claimed
CN-102140062-B Method for preparing 2,5-dimethyl phenylacetic acid LIANHE CHEMICAL TECHNOLOGY CO LTD 2012-11-14 CN claimed
CN-102746225-A Preparation method of 2-alkyl-3,4-disubstituted isoquinolyl-1(2H)-ketone derivative UNIV TIANJIN 2012-10-24 CN claimed
CN-102746224-A Preparation method of 2-aryl-3,4-disubstituted isoquinolyl-1(2H)-ketone derivative UNIV TIANJIN 2012-10-24 CN claimed
CN-102140062-A Method for preparing 2,5-dimethyl phenylacetic acid LIANHE CHEMICAL TECHNOLOGY CO LTD 2011-08-03 CN claimed