Acetic Acid

Acetic Acid

SCHEMBL4451384

CC(=O)O.CCC(O)OC(C)COC

nearest known ligand 0.44

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 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.44

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
SCHEMBL1349118 0.90 TSHR (0.55) TSHR
Acetic Acid SCHEMBL5485514 0.83 FFAR3 (0.35) TSHR
SCHEMBL16237352 0.82 TSHR (0.46) TSHR
Methacrylic Acid SCHEMBL28144780 0.75 TSHR (0.39) TSHR
Acetic Acid SCHEMBL7262426 0.74 FFAR3 (0.35) TSHR
Acetic Acid SCHEMBL1880325 0.74 FFAR3 (0.35) TSHR
Acetic Acid SCHEMBL13719102 0.74 FFAR3 (0.35) TSHR
SCHEMBL17628512 0.74 TSHR (0.41) TSHR
Acetic Acid SCHEMBL7090485 0.74 TDP1 (0.35) TSHR
2-Methoxyethanol SCHEMBL28236376 0.73 TSHR (0.40) TSHR

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
WO-2009108850-A2 COATING COMPOSITION AND METHOD OF APPLICATION PERES CARL (US) 2009-09-03 WO disclosed
US-20090220700-A1 Coating Composition And Method Of Application PERES CARL 2009-09-03 US disclosed