Acetic Acid

Acetic Acid

SCHEMBL4909754

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nearest known ligand 0.54

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
FFAR3 O14843 3/20 0.54
LCK P06239 1/20 0.54
FYN P06241 1/20 0.54
ALDH1A1 P00352 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
GLRA1 P23415 1/20 0.44
SLC6A9 P48067 1/20 0.44
OR51E2 Q9H255 1/20 0.44
LMNA P02545 4/20 0.40
ALOX15 P16050 2/20 0.40
BLM P54132 1/20 0.40
PMP22 Q01453 1/20 0.40
HDAC3 O15379 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
SLC15A2 Q16348 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GABRR1 P24046 2/20 0.35
PAOX Q6QHF9 1/20 0.35

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 SCHEMBL10944981 1.00 FFAR3 (0.54) FFAR3LCKFYNALDH1A1TDP1
Acetic Acid SCHEMBL19209974 1.00
Acetic Acid SCHEMBL3389581 1.00 FFAR3 (0.54) FFAR3LCKFYNALDH1A1TDP1
Acetic Acid SCHEMBL30992289 0.96 FFAR3 (0.58) FFAR3LCKFYNALDH1A1TDP1
Acetic Acid SCHEMBL7880095 0.96 FFAR3 (0.58) FFAR3LCKFYNALDH1A1TDP1
Acetic Acid SCHEMBL8676850 0.96 FFAR3 (0.58) FFAR3LCKFYNALDH1A1TDP1
Acetic Acid SCHEMBL1025735 0.96
Acetic Acid SCHEMBL10766537 0.96 FFAR3 (0.58) FFAR3LCKFYNALDH1A1TDP1
Acetic Acid SCHEMBL9350314 0.96 FFAR3 (0.58) FFAR3LCKFYNALDH1A1TDP1
Acetic Acid SCHEMBL8064727 0.92

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
US-20080050762-A1 METHODS AND COMPOSITIONS FOR COUPLED LUMINESCENT ASSAYS COREY MICHAEL J 2008-02-28 US disclosed
US-6811990-B1 RAPID/FLEXIBLE MEASUREMENT OF CELL CYTOTOXICITY AND/OR PROLIFERATION; ENZYMATIC ACTIVITY COUPLED TO PRODUCTION OF HIGH-ENERGY MOLECULE (ATP) WHICH SERVES AS A SUBSTRATE FOR ILLUMINATION BY A LUCIFERASE; PHOSPHATASES Corey, Michael J. 2004-11-02 US disclosed
US-20030190368-A1 METHODS OF DIAGNOSIS AND TRIAGE USING CELL ACTIVATION MEASURES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-10-09 US disclosed
EP-1062323-A2 METHODS OF DIAGNOSIS AND TRIAGE USING CELL ACTIVATION MEASURES Cell Activation, Inc. (US) 2000-12-27 EP disclosed
WO-1999046367-A2 METHODS OF DIAGNOSIS AND TRIAGE USING CELL ACTIVATION MEASURES CELL ACTIVATION, INC. (US) 1999-09-16 WO disclosed
EP-0270217-B1 BLEACH-FIXING SOLUTION HAVING GOOD PROCESSING PERFORMANCE AND METHOD FOR PROCESSING LIGHT-SENSITIVE MATERIAL USING THE SAME KONICA CORPORATION (JP) 1993-08-04 EP 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-20030190368-A1 METHODS OF DIAGNOSIS AND TRIAGE USING CELL ACTIVATION MEASURES SERPINB1, PLAT, SERPINE1 FFAR3 2945/4885LCK 1076/4885FYN 1097/4885

“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.