Acetic Acid

Acetic Acid

SCHEMBL3194491

C=CCCCC=CC.CC(=O)O

nearest known ligand 0.48

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 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
ABCC4 O15439 1/20 0.48
LMNA P02545 3/20 0.45
USP2 O75604 2/20 0.45
RECQL P46063 2/20 0.45
CYP3A4 P08684 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ALDH1A1 P00352 4/20 0.42
CNR1 P21554 1/20 0.38
TSHR P16473 1/20 0.37
GMNN O75496 1/20 0.35
CYP1A2 P05177 1/20 0.35
POLB P06746 1/20 0.35
CYP2C9 P11712 1/20 0.35
ALOX15 P16050 1/20 0.35
APEX1 P27695 1/20 0.35
CYP2C19 P33261 1/20 0.35
BLM P54132 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSD17B10 Q99714 1/20 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
Acetic Acid SCHEMBL3194485 1.00 MAPT (0.48) MAPTABCC4LMNAUSP2RECQL
Acetic Acid SCHEMBL28522340 0.94 MAPT (0.57) MAPTABCC4LMNAUSP2RECQL
Acetic Acid SCHEMBL28514189 0.94 MAPT (0.57) MAPTABCC4LMNAUSP2RECQL
Propionic Acid SCHEMBL21080966 0.88 MAPT (0.50) MAPTABCC4LMNAUSP2RECQL
Propionic Acid SCHEMBL21080968 0.88 MAPT (0.50) MAPTABCC4LMNAUSP2RECQL
SCHEMBL22094 0.86
SCHEMBL6474826 0.86
SCHEMBL22093 0.86
SCHEMBL25185257 0.84 TSHR (0.46) MAPTABCC4LMNAUSP2RECQL
SCHEMBL1535152 0.84 TSHR (0.46) MAPTABCC4LMNAUSP2RECQL

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100115708-A1 Laundry System Having Unitized Dosing CASWELL DEBRA SUE 2010-05-13 US disclosed
US-20100035789-A1 Laundry System Having Unitized Dosing CASWELL DEBRA SUE 2010-02-11 US disclosed
US-7544651-B2 Laundry system having unitized dosing THE PROCTER & GAMBLE COMPANY (US) 2009-06-09 US disclosed
US-7534758-B2 Laundry system having unitized dosing THE PROCTER & GAMBLE COMPANY (US) 2009-05-19 US disclosed
US-20090062173-A1 Laundry System Having Unitized Dosing CASWELL DEBRA SUE 2009-03-05 US disclosed
US-7494965-B2 Laundry system having unitized dosing THE PROCTER & GAMBLE COMPANY (US) 2009-02-24 US disclosed
US-20080009432-A1 Laundry system having unitized dosing CASWELL DEBRA S 2008-01-10 US disclosed
US-20070111918-A1 Laundry system having unitized dosing CASWELL DEBRA S 2007-05-17 US disclosed
US-7186680-B2 Laundry system having unitized dosing THE PROCTER & GAMBLE COMPANY (US) 2007-03-06 US disclosed
US-7166565-B2 Laundry system having unitized dosing THE PROCTER & GAMBLE COMPANY (US) 2007-01-23 US disclosed
US-20060168739-A1 HIGHLY CONCENTRATED FABRIC SOFTENER COMPOSITIONS AND ARTICLES CONTAINING SUCH COMPOSITIONS CASWELL DEBRA S 2006-08-03 US disclosed
US-20060123556-A1 Laundry system having unitized dosing CASWELL DEBRA S 2006-06-15 US disclosed
US-20060123557-A1 Laundry system having unitized dosing CASWELL DEBRA S 2006-06-15 US disclosed
US-20050250670-A1 Highly concentrated fabric softener compositions and articles containing such compositions CASWELL DEBRA S 2005-11-10 US disclosed
US-6958313-B2 Highly concentrated fabric softener compositions and articles containing such compositions THE PROCTER & GAMBLE COMPANY (US) 2005-10-25 US disclosed
US-20050202990-A1 Laundry system having unitized dosing THE PROCTER & GAMBLE COMPANY 2005-09-15 US disclosed
US-20050176611-A1 Laundry system having unitized dosing CASWELL DEBRA S (CN) 2005-08-11 US disclosed
US-20050079993-A1 Highly concentrated fabric softener compositions and articles containing such compositions THE PROCTER & GAMBLE COMPANY CORPORATION 2005-04-14 US disclosed
US-6451065-B2 CONTACTING WITH A MIXTURE OF PERFUME, A METALLIC SALT, SUCH AS ZINC CHLORIDE, AN OPTIONAL SOLUBILIZER, AND AQUEOUS CARRIER; DOES NOT SOIL OR STAIN FABRIC THE PROCTER & GAMBLE COMPANY 2002-09-17 US disclosed
CN-1215048-A Vitamin A related compounds and methods for their production SUMITOMO CHEMICAL CO (JP) 1999-04-28 CN disclosed