Acetic Acid

Acetic Acid

SCHEMBL6131040

CC(=O)O.CC(=O)O.NCC(N)(O)O

nearest known ligand 0.44

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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 1/20 0.44
LCK P06239 1/20 0.44
FYN P06241 1/20 0.44
KDM4E B2RXH2 2/20 0.40
GLRA1 P23415 1/20 0.37
SLC6A9 P48067 1/20 0.37
OR51E2 Q9H255 1/20 0.37
ARG1 P05089 2/20 0.35
ARG2 P78540 2/20 0.35
ALDH1A1 P00352 2/20 0.35
TSHR P16473 1/20 0.35
HMGCR P04035 1/20 0.35
CHRM1 P11229 1/20 0.35
TBXA2R P21731 1/20 0.35
ADRA1A P35348 1/20 0.35
LMNA P02545 2/20 0.33
ALOX15 P16050 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31

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 SCHEMBL28726920 0.85 KDM4E (0.44) FFAR3LCKFYNKDM4EGLRA1
Acetic Acid SCHEMBL8516620 0.84 FFAR3 (0.47) FFAR3LCKFYNKDM4EGLRA1
Acetic Acid SCHEMBL319923 0.84 FFAR3 (0.47) FFAR3LCKFYNKDM4EGLRA1
Acetic Acid SCHEMBL3641038 0.84 FFAR3 (0.47) FFAR3LCKFYNKDM4EGLRA1
Acetic Acid SCHEMBL5710582 0.84 FFAR3 (0.47) FFAR3LCKFYNKDM4EGLRA1
Acetic Acid SCHEMBL9846828 0.81 KDM4E (0.46) FFAR3LCKFYNKDM4EGLRA1
Acetic Acid SCHEMBL28281534 0.81 KDM4E (0.46) FFAR3LCKFYNKDM4EGLRA1
Acetic Acid SCHEMBL27531087 0.81 FFAR3 (0.44) FFAR3LCKFYNKDM4EGLRA1
Acetic Acid SCHEMBL4404139 0.81 KDM4E (0.46) FFAR3LCKFYNKDM4EGLRA1
Acetic Acid SCHEMBL28212914 0.79

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
US-20050246828-A1 Hygiene washing apparatus PANASONIC CORPORATION (JP) 2005-11-10 US disclosed
EP-1536075-A1 HYGIENE WASHING APPARATUS MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2005-06-01 EP disclosed