Acetic Acid

Acetic Acid

SCHEMBL4944005

CC(=O)[O-].CC(=O)[O-].O=C(O)O.O=C(O)O.[Ca+2]

nearest known ligand 0.73

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 3/20 0.73
CA4 P22748 3/20 0.50
FFAR3 O14843 3/20 0.50
LCK P06239 1/20 0.50
FYN P06241 1/20 0.50
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
LMNA P02545 3/20 0.42
TSHR P16473 2/20 0.39
THPO P40225 1/20 0.39
ALOX15 P16050 1/20 0.36
BLM P54132 1/20 0.36
PMP22 Q01453 1/20 0.36
FAHD1 Q6P587 1/20 0.36
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
SLC15A2 Q16348 1/20 0.32
ALDH1A1 P00352 2/20 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 SCHEMBL28329021 1.00 CA1 (0.73) CA1CA4FFAR3LCKFYN
Acetic Acid SCHEMBL23924735 0.95 CA1 (0.80) CA1CA4FFAR3LCKFYN
Acetic Acid SCHEMBL28493690 0.91 CA1 (0.73) CA1CA4FFAR3LCKFYN
Acetic Acid SCHEMBL5479034 0.91
Acetic Acid SCHEMBL28810668 0.91
Acetic Acid SCHEMBL7540275 0.91 CA1 (0.73) CA1CA4FFAR3LCKFYN
Acetic Acid SCHEMBL3213377 0.91
Acetic Acid SCHEMBL9123559 0.91 CA1 (0.73) CA1CA4FFAR3LCKFYN
Acetic Acid SCHEMBL29066511 0.91
Acetic Acid SCHEMBL27205411 0.91

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080057025-A1 Method for promoting bone formation BURKE STEVEN K 2008-03-06 US disclosed
US-7220406-B2 Method for promoting bone formation GENZYME CORPORATION (US) 2007-05-22 US disclosed
US-20040120922-A1 Method for promoting bone formation GENZYME CORPORATION 2004-06-24 US disclosed
WO-2004037274-A1 AMINE POLYMERS FOR PROMOTING BONE FORMATION GENZYME CORPORATION (US) 2004-05-06 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 (2 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-20080057025-A1 Method for promoting bone formation BMP2, VCL, BMP4 CA1 3570/4885CA4 1297/4885FFAR3 4422/4885
US-20040120922-A1 Method for promoting bone formation BMP2, VCL, BMP4 CA1 3231/4885CA4 1310/4885FFAR3 4443/4885

“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.