Acetic Acid

Acetic Acid

SCHEMBL28452500

CC(=O)[O-].O=C(O)CP(=O)(O)OO.[Na+]

nearest known ligand 0.41

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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 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
BLM P54132 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CA1 P00915 2/20 0.38

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
SCHEMBL560738 0.87
SCHEMBL28292374 0.84 MEN1 (0.50) MEN1LMNAHPGDTSHRBLM
Hydrochloric Acid SCHEMBL27933376 0.84 MEN1 (0.50) MEN1LMNAHPGDTSHRBLM
SCHEMBL28455146 0.78 CA4 (0.35) MEN1LMNAHPGDTSHRBLM
Etidronic Acid SCHEMBL9847244 0.76 LMNA (0.50) MEN1LMNAHPGDTSHRBLM
Potassium Ion SCHEMBL28588111 0.73 SLC34A1 (0.32) MEN1LMNAHPGDTSHRBLM
SCHEMBL28384070 0.73 MEN1 (0.31) MEN1LMNAHPGDTSHRBLM
SCHEMBL37980 0.70
Phosphoric Acid SCHEMBL1677256 0.68 CA1 (0.69) MEN1LMNABLMKMT2ACA1
SCHEMBL9081757 0.67 LMNA (0.46) MEN1LMNAHPGDTSHRBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111631217-A Low-odor low-corrosivity neutral peroxyacetic acid disinfectant and preparation method thereof 山东利尔康医疗科技股份有限公司 2020-09-08 CN disclosed