Acetic Acid

Acetic Acid

SCHEMBL6841023

CC(=O)O.CC(=O)O.CC(=O)O.O=[N+]([O-])[O-].[Y]

nearest known ligand 0.54

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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 0.54
LCK P06239 1/20 0.54
FYN P06241 1/20 0.54
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CA1 P00915 2/20 0.40
CA5A P35218 1/20 0.40
CA5B Q9Y2D0 1/20 0.40
LMNA P02545 3/20 0.36
BLM P54132 2/20 0.36
HBB P68871 1/20 0.36
HIF1A Q16665 1/20 0.36
CA4 P22748 2/20 0.35
MAPK1 P28482 1/20 0.35
TSHR P16473 2/20 0.33
THPO P40225 1/20 0.33
FBP1 P09467 1/20 0.32
CPA1 P15085 1/20 0.32
ALOX15 P16050 1/20 0.31
PMP22 Q01453 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 SCHEMBL7517423 1.00
Acetic Acid SCHEMBL27672369 0.92 FFAR3 (0.54) FFAR3LCKFYNMEN1KMT2A
Acetic Acid SCHEMBL6855692 0.92
Acetic Acid SCHEMBL27506078 0.92 FFAR3 (0.54) FFAR3LCKFYNMEN1KMT2A
Acetic Acid SCHEMBL28795718 0.92 FFAR3 (0.54) FFAR3LCKFYNMEN1KMT2A
Acetic Acid SCHEMBL10595188 0.92 FFAR3 (0.54) FFAR3LCKFYNMEN1KMT2A
Acetic Acid SCHEMBL28032779 0.92 FFAR3 (0.54) FFAR3LCKFYNMEN1KMT2A
Acetic Acid SCHEMBL12544195 0.92 FFAR3 (0.54) FFAR3LCKFYNMEN1KMT2A
Acetic Acid SCHEMBL28610104 0.92
Acetic Acid SCHEMBL28148899 0.92 FFAR3 (0.54) FFAR3LCKFYNMEN1KMT2A

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
CN-116199249-A Preparation method of micro-nano structure yttrium oxide with controllable structure morphology, product and application thereof 长沙矿冶研究院有限责任公司 2023-06-02 CN disclosed
US-6770131-B2 PREFERABLY THIN FILMS OF GALLIUM NITRIDE; DIRECT DEPOSITION OF AN AMORPHOUS LAYER OF A III-V COMPOUND PRECURSOR ON A SINGLE CRYSTAL SUBSTRATE; REACTION, CRYSTALLIZATION AND FORMATION OF FILMS BY PYROLYSIS. THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2004-08-03 US disclosed
US-20030012874-A1 III-V compound films using chemical deposition REGENTS OF THE UNIVERSITY OF CALIFORNIA, THE 2003-01-16 US disclosed
WO-2002040752-A2 PROCESS FOR PRODUCING III-V COMPOUND FILMS BY CHEMICAL DEPOSITION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2002-05-23 WO disclosed