Acetic Acid

Acetic Acid

SCHEMBL2087759

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nearest known ligand 0.00

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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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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 SCHEMBL299432 1.00 CA1 (0.80)
Acetic Acid SCHEMBL6355263 1.00 CA1 (0.80)
Acetic Acid SCHEMBL2301238 1.00 CA1 (0.80)
Acetic Acid SCHEMBL1541386 0.95 CA1 (0.73)
Acetic Acid SCHEMBL28407128 0.95 CA1 (0.73)
Acetic Acid SCHEMBL19671 0.95 CA1 (0.89)
Acetic Acid SCHEMBL7111972 0.90
Acetic Acid SCHEMBL11134030 0.90
Acetic Acid SCHEMBL7060080 0.90 CA1 (0.80)
Acetic Acid SCHEMBL11446443 0.90

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
US-8163049-B2 Fluoride-modified silica sols for chemical mechanical planarization DUPONT AIR PRODUCTS NANOMATERIALS LLC (US) 2012-04-24 US disclosed
US-20070251156-A1 Fluoride-modified silica sols for chemical mechanical planarization VERSUM MATERIALS US, LLC 2007-11-01 US disclosed