Acetic Acid

Acetic Acid

SCHEMBL27973702

CC(=O)[O-].[I-].[K+].[Na+]

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 SCHEMBL9341460 0.95
Acetic Acid SCHEMBL6278277 0.95
Acetic Acid SCHEMBL27241878 0.95 CA1 (0.90)
Acetic Acid SCHEMBL2598301 0.95 CA1 (0.90)
Acetic Acid SCHEMBL5508334 0.91
Acetic Acid SCHEMBL9725085 0.91 CA1 (0.73)
Acetic Acid SCHEMBL3714201 0.91 CA1 (0.82)
Acetic Acid SCHEMBL31075986 0.91
Acetic Acid SCHEMBL9756535 0.91 CA1 (0.73)
Acetic Acid SCHEMBL28849631 0.91 CA1 (0.82)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104098781-B A kind of method utilizing Concretio silicea Bambusae seu schizostachyi waste material to produce degradable liquid mulch film 华中农业大学 2016-08-17 CN claimed
CN-104098781-B A kind of method utilizing Concretio silicea Bambusae seu schizostachyi waste material to produce degradable liquid mulch film 华中农业大学 2016-08-17 CN disclosed
CN-104098781-B A kind of method utilizing Concretio silicea Bambusae seu schizostachyi waste material to produce degradable liquid mulch film 华中农业大学 2016-08-17 CN disclosed
CN-104098781-A Method utilizing tabasheer waste to produce degradable liquid mulching film UNIV HUAZHONG AGRICULTURAL 2014-10-15 CN disclosed