Acetic Acid

Acetic Acid

SCHEMBL28017112

CC(=O)[O-].CC(=O)[O-].O=O.[Zn+2].c1c[nH]nn1.c1c[nH]nn1

nearest known ligand 0.35

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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 1)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 2/20 0.35

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 SCHEMBL28017659 0.98 CA1 (0.36) CA1
Acetic Acid SCHEMBL28014079 0.93 CA1 (0.36) CA1
Acetic Acid SCHEMBL3807264 0.93 CA1 (0.41) CA1
Acetic Acid SCHEMBL28691473 0.93 CA1 (0.36) CA1
Acetic Acid SCHEMBL28062930 0.89 CA1 (0.33) CA1
Bicarbonate SCHEMBL28339698 0.84 — —
Acetamide SCHEMBL28350256 0.82 — —
Hydrochloric Acid SCHEMBL28821874 0.80 — —
Oxygen SCHEMBL28019161 0.78 — —
Hydrochloric Acid SCHEMBL28005900 0.78 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104610307-A Zinc oxyether bistriazol acetate complex with potential fluorescent material and preparation method of complex UNIV TIANJIN NORMAL 2015-05-13 — — CN disclosed
CN-104610307-A Zinc oxyether bistriazol acetate complex with potential fluorescent material and preparation method of complex UNIV TIANJIN NORMAL 2015-05-13 — — CN disclosed
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