Acetic Acid

Acetic Acid

SCHEMBL28296552

CC(=O)O.CCCCN1C=CN(CCCC)C1

nearest known ligand 0.38

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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 20)

geneUniProtsupporting neighboursconfidence
ESR1 known ✓ P03372 1/20 0.32
CA2 P00918 2/20 0.38
MAPK1 P28482 1/20 0.38
GLB1 P16278 1/20 0.35
OGA O60502 1/20 0.34
AKR1B1 P15121 1/20 0.33
USP2 O75604 1/20 0.33
GPR84 Q9NQS5 5/20 0.32
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
CA1 P00915 1/20 0.32
FFAR1 O14842 1/20 0.32
PPARG P37231 3/20 0.32
PPARD Q03181 3/20 0.32
PPARA Q07869 3/20 0.32
TSHR P16473 2/20 0.32
HDAC11 Q96DB2 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
ALDH1A1 P00352 1/20 0.32

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 SCHEMBL29199140 0.94 CA2 (0.34) CA2MAPK1GLB1OGAAKR1B1
Acetic Acid SCHEMBL28640717 0.92 GUSB (0.39) GPR84FFAR1PPARGPPARDPPARA
Acetic Acid SCHEMBL28308309 0.90 CA2 (0.34) CA2MAPK1GLB1OGAAKR1B1
Acetic Acid SCHEMBL3459442 0.90 CA2 (0.34) CA2MAPK1GLB1OGAAKR1B1
SCHEMBL329125 0.87 GLB1 (0.38) GLB1TSHRALDH1A1KMT2A
SCHEMBL27839877 0.86 KDM4E (0.39) CA2MAPK1GLB1AKR1B1GPR84
Bicarbonate SCHEMBL29180172 0.86 GPR84 (0.40) GPR84FFAR1PPARGPPARDPPARA
Acetic Acid SCHEMBL28603498 0.86 CA2 (0.32) CA2MAPK1GLB1OGA
Acetic Acid SCHEMBL28281190 0.85 GUSB (0.33) CA2MAPK1AKR1B1GPR84FFAR1
Bromide SCHEMBL23071102 0.84 GLB1 (0.37) GLB1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120026412-A Mushroom fiber electrode and preparation method thereof 武汉纺织大学 2025-05-23 CN claimed
CN-119956526-A Mushroom fiber, green preparation method and application thereof 武汉纺织大学 2025-05-09 CN claimed
CN-120026412-A Mushroom fiber electrode and preparation method thereof 武汉纺织大学 2025-05-23 CN disclosed
CN-119956526-A Mushroom fiber, green preparation method and application thereof 武汉纺织大学 2025-05-09 CN disclosed
CN-109790292-A Process for preparing polybenzazole polymer (P) 巴斯夫欧洲公司 2019-05-21 CN disclosed