Acetic Acid

Acetic Acid

SCHEMBL6662900

CC(=O)O.CC(=O)O.CC(=O)O.NCN

nearest known ligand 0.64

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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
FFAR3 O14843 2/20 0.64
LCK P06239 1/20 0.64
FYN P06241 1/20 0.64
GLRA1 P23415 1/20 0.50
SLC6A9 P48067 1/20 0.50
OR51E2 Q9H255 1/20 0.50
LMNA P02545 4/20 0.46
BLM P54132 2/20 0.46
ALOX15 P16050 1/20 0.46
PMP22 Q01453 1/20 0.46
ALDH1A1 P00352 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
SLC15A2 Q16348 1/20 0.39
TSHR P16473 2/20 0.39
ACHE P22303 1/20 0.39
THPO P40225 1/20 0.39
GABRR1 P24046 3/20 0.38
PAOX Q6QHF9 1/20 0.38
TRPA1 O75762 1/20 0.38
KDM4E B2RXH2 2/20 0.37

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 SCHEMBL449532 1.00 FFAR3 (0.64) FFAR3LCKFYNGLRA1SLC6A9
Acetic Acid SCHEMBL31377001 1.00 FFAR3 (0.64) FFAR3LCKFYNGLRA1SLC6A9
Acetic Acid SCHEMBL10946765 0.96 FFAR3 (0.58) FFAR3LCKFYNGLRA1SLC6A9
Acetic Acid SCHEMBL870378 0.92 FFAR3 (0.54) FFAR3LCKFYNGLRA1SLC6A9
Acetic Acid SCHEMBL27792206 0.92 FFAR3 (0.54) FFAR3LCKFYNGLRA1SLC6A9
Acetic Acid SCHEMBL7155336 0.92 FFAR3 (0.54) FFAR3LCKFYNGLRA1SLC6A9
Acetic Acid SCHEMBL9098767 0.87 FFAR3 (0.58) FFAR3LCKFYNGLRA1SLC6A9
Acetic Acid SCHEMBL1025735 0.87
Acetic Acid SCHEMBL3634629 0.87 FFAR3 (0.58) FFAR3LCKFYNGLRA1SLC6A9
Acetic Acid SCHEMBL1140278 0.87

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0786698-B1 Organic/inorganic developer composition EASTMAN KODAK CO (US) 2004-08-04 EP claimed
US-6083673-A REGENERATABLE IRON CHELATE, NOVEL CODEVELOPERS OF PHENIDONE TYPE INCLUDING SOLUBILIZING GROUPS THAT ARE NOT DIRECTLY ATTACHED TO THE PHENYL NUCLEUS OR PYRAZOLIDINO NUCLEUS AND OPTIONALLY ASCORBIC ACID, FAST DEVELOPMENT OF RADIOGRAPHIC EASTMAN KODAK COMPANY (US) 2000-07-04 US claimed
EP-0786698-A1 Organic/inorganic developer composition EASTMAN KODAK COMPANY (US) 1997-07-30 EP claimed
EP-0786698-B1 Organic/inorganic developer composition EASTMAN KODAK CO (US) 2004-08-04 EP disclosed
US-6083673-A REGENERATABLE IRON CHELATE, NOVEL CODEVELOPERS OF PHENIDONE TYPE INCLUDING SOLUBILIZING GROUPS THAT ARE NOT DIRECTLY ATTACHED TO THE PHENYL NUCLEUS OR PYRAZOLIDINO NUCLEUS AND OPTIONALLY ASCORBIC ACID, FAST DEVELOPMENT OF RADIOGRAPHIC EASTMAN KODAK COMPANY (US) 2000-07-04 US disclosed
EP-0786698-A1 Organic/inorganic developer composition EASTMAN KODAK COMPANY (US) 1997-07-30 EP disclosed