Acetic Acid

Acetic Acid

SCHEMBL28434451

CC(=O)O.CC(=O)O.O=NCC(=O)O.[NaH]

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 19)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 3/20 0.41
LCK P06239 1/20 0.41
FYN P06241 1/20 0.41
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
HSD17B10 Q99714 1/20 0.37
LMNA P02545 2/20 0.35
SLC15A2 Q16348 1/20 0.35
CTH P32929 1/20 0.33
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
POLB P06746 1/20 0.30
LDHA P00338 1/20 0.30
SRR Q9GZT4 1/20 0.30
ALKBH5 Q6P6C2 1/20 0.30
SUCNR1 Q9BXA5 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30

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 SCHEMBL28389016 1.00 FFAR3 (0.41) FFAR3LCKFYNCYP1A2CYP2D6
SCHEMBL14915801 0.84
SCHEMBL3590719 0.84
SCHEMBL13053943 0.71
Acetic Acid SCHEMBL1323545 0.71 FFAR3 (0.41) FFAR3LCKFYNCYP1A2CYP2D6
Acetic Acid SCHEMBL27522628 0.70
Acetic Acid SCHEMBL11049062 0.69 FFAR3 (0.88) FFAR3LCKFYNLMNASLC15A2
Acetic Acid SCHEMBL655 0.69
Acetic Acid SCHEMBL5328943 0.69 FFAR3 (0.88) FFAR3LCKFYNLMNASLC15A2
Acetic Acid SCHEMBL21693850 0.69 FFAR3 (0.88) FFAR3LCKFYNLMNASLC15A2

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-108455752-B Construction sewage treatment system 温州诚力工程项目管理有限公司 2021-02-05 CN disclosed
CN-106604983-B Self-adhering cleaning block and cleaning article and method of making the block and article 约翰逊父子公司 2020-07-24 CN disclosed