Acetic Acid

Acetic Acid

SCHEMBL4655822

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nearest known ligand 0.89

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
CA1 P00915 2/20 0.89
CA4 P22748 3/20 0.73
FAHD1 Q6P587 1/20 0.55
LMNA P02545 2/20 0.50
TSHR P16473 2/20 0.46
THPO P40225 1/20 0.46
FFAR3 O14843 1/20 0.46
LCK P06239 1/20 0.46
FYN P06241 1/20 0.46
BLM P54132 2/20 0.43
MEN1 O00255 1/20 0.43
LDHA P00338 1/20 0.43
KMT2A Q03164 1/20 0.43
ALOX15 P16050 1/20 0.42
PMP22 Q01453 1/20 0.42
ALDH1A1 P00352 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
KDM4E B2RXH2 1/20 0.36
CA2 P00918 1/20 0.36
PTGS1 P23219 1/20 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 SCHEMBL9116209 1.00 CA1 (0.89) CA1CA4FAHD1LMNATSHR
Acetic Acid SCHEMBL9118173 1.00 CA1 (0.89) CA1CA4FAHD1LMNATSHR
Acetic Acid SCHEMBL9117468 1.00 CA1 (0.89) CA1CA4FAHD1LMNATSHR
Acetic Acid SCHEMBL9117998 1.00 CA1 (0.89) CA1CA4FAHD1LMNATSHR
Acetic Acid SCHEMBL1254 1.00
Acetic Acid SCHEMBL3447879 1.00 CA1 (0.89) CA1CA4FAHD1LMNATSHR
Acetic Acid SCHEMBL5049841 1.00 CA1 (0.89) CA1CA4FAHD1LMNATSHR
Acetic Acid SCHEMBL9120233 1.00 CA1 (0.89) CA1CA4FAHD1LMNATSHR
Acetic Acid SCHEMBL2598301 0.95 CA1 (0.90) CA1CA4FAHD1LMNATSHR
Acetic Acid SCHEMBL6278277 0.95

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1345884-A1 ANTI-VIRAL COMPOUNDS Aids Care Pharma Limited (IE) 2003-09-24 EP claimed
WO-2002044121-A1 ANTI-VIRAL COMPOUNDS AIDS CARE PHARMA LIMITED (IE) 2002-06-06 WO claimed
EP-1367044-B1 Calixarene-derivatives having anti-viral activity AIDS CARE PHARMA LTD (IE) 2008-11-19 EP disclosed
US-7338977-B2 Anti-viral compounds AIDS CARE PHARMA LIMITED (IE) 2008-03-04 US disclosed
US-20050113454-A1 Anti-viral compounds AIDS CARE PHARMA LIMITED (IE) 2005-05-26 US disclosed
EP-1367044-A1 Calixarene-derivatives having anti-viral activity Aids Care Pharma Limited (IE) 2003-12-03 EP disclosed
EP-1345884-A1 ANTI-VIRAL COMPOUNDS Aids Care Pharma Limited (IE) 2003-09-24 EP disclosed
WO-2002044121-A1 ANTI-VIRAL COMPOUNDS AIDS CARE PHARMA LIMITED (IE) 2002-06-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050113454-A1 Anti-viral compounds RNASEH1, H1-0, SARS1 CA1 3385/4885CA4 2061/4885FAHD1 778/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.