Acetic Acid

Acetic Acid

SCHEMBL2993587

C=CC(=O)OCC(C)C(C)(C)N.CC(=O)O

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

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 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.55
ALDH1A1 P00352 4/20 0.37
TP53 P04637 3/20 0.37
HIF1A Q16665 3/20 0.37
CYP3A4 P08684 2/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.36
THRB P10828 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
SCHEMBL27947863 0.95 TSHR (0.60) TSHRALDH1A1TP53HIF1ACYP3A4
Water SCHEMBL31298579 0.93 TSHR (0.58) TSHRALDH1A1TP53HIF1ACYP3A4
Bromide SCHEMBL2991497 0.93 TSHR (0.58) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL13268647 0.80 TSHR (0.64) TSHRALDH1A1TP53HIF1ACYP3A4
Bromide SCHEMBL21245514 0.77 TSHR (0.46) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL23493932 0.76 TSHR (0.58) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL20015418 0.75 TSHR (0.62) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL236553 0.75 TSHR (0.56) TSHRALDH1A1TP53HIF1ACYP3A4
Acetic Acid SCHEMBL28264238 0.74 TSHR (0.60) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL3929660 0.74 TSHR (0.60) TSHRALDH1A1THRB

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
US-20100173104-A1 MANUFACTURING METHOD OF RECORDING MEDIUM, INKJET RECORDING MEDIUM, AND METHOD OF MANUFACTURING THE SAME FUJIFILM CORPORATION (JP) 2010-07-08 US disclosed
EP-2004416-B1 INKJET RECORDING MEDIUM, AND METHOD OF MANUFACTURING THE SAME FUJIFILM CORP (JP) 2010-05-05 EP disclosed
EP-2004416-A4 MANUFACTURING METHOD OF RECORDING MEDIUM, INKJET RECORDING MEDIUM, AND METHOD OF MANUFACTURING THE SAME FUJIFILM CORP (JP) 2009-08-05 EP disclosed
EP-2004416-A1 MANUFACTURING METHOD OF RECORDING MEDIUM, INKJET RECORDING MEDIUM, AND METHOD OF MANUFACTURING THE SAME FUJIFILM Corporation (JP) 2008-12-24 EP disclosed
WO-2007116776-A1 MANUFACTURING METHOD OF RECORDING MEDIUM, INKJET RECORDING MEDIUM, AND METHOD OF MANUFACTURING THE SAME FUJIFILM CORPORATION (JP) 2007-10-18 WO disclosed