Acetic Acid

Acetic Acid

SCHEMBL8630630

CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(CN)CN

nearest known ligand 0.46

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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
GABBR2 O75899 1/20 0.46
GABBR1 Q9UBS5 1/20 0.46
FFAR3 O14843 1/20 0.44
LCK P06239 1/20 0.44
FYN P06241 1/20 0.44
GABRR1 P24046 4/20 0.42
CACNA2D1 P54289 2/20 0.41
CACNB3 P54284 1/20 0.41
CACNA1C Q13936 1/20 0.41
PGR P06401 1/20 0.41
ADRA1A P35348 1/20 0.41
HTR2B P41595 1/20 0.41
CACNA2D2 Q9NY47 1/20 0.41
LMNA P02545 1/20 0.38
ALDH1A1 P00352 2/20 0.37
GLRA1 P23415 1/20 0.37
SLC6A9 P48067 1/20 0.37
OR51E2 Q9H255 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
GABRP O00591 2/20 0.36

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 SCHEMBL7704585 0.84
Acetic Acid SCHEMBL11454635 0.81 CACNA2D1 (0.46) FFAR3LCKFYNGABRR1CACNA2D1
Acetic Acid SCHEMBL28858092 0.81 ALDH1A1 (0.62) FFAR3LCKFYNGABRR1CACNA2D1
Acetic Acid SCHEMBL3336394 0.81 ALDH1A1 (0.62) FFAR3LCKFYNGABRR1CACNA2D1
Acetic Acid SCHEMBL8817349 0.81
Acetic Acid SCHEMBL21227 0.81 ALDH1A1 (0.62) FFAR3LCKFYNGABRR1CACNA2D1
Acetic Acid SCHEMBL2678979 0.81
Acetic Acid SCHEMBL6150069 0.81 ALDH1A1 (0.62) FFAR3LCKFYNGABRR1CACNA2D1
Acetic Acid SCHEMBL12474237 0.81 ALDH1A1 (0.62) FFAR3LCKFYNGABRR1CACNA2D1
Acetic Acid SCHEMBL27861656 0.81 FFAR3 (0.44) FFAR3LCKFYNGABRR1CACNA2D1

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
EP-0540990-B1 Tablet-shaped processing agent and method for processing silver halide photographic light sensitive materials KONISHIROKU PHOTO IND (JP) 1998-07-15 EP disclosed
US-5366853-A Bleaches for photographic films KONICA CORPORATION (JP) 1994-11-22 US disclosed
US-5362610-A Photographic processing agent KONICA CORPORATION (JP) 1994-11-08 US disclosed
EP-0540990-A1 Tablet-shaped processing agent and method for processing silver halide photographic light sensitive materials KONICA CORPORATION (JP) 1993-05-12 EP disclosed
EP-0540296-A1 Photographic processing agent KONICA CORPORATION (JP) 1993-05-05 EP disclosed