Acetic Acid

Acetic Acid

SCHEMBL599482

CC(=O)O.CCCCCCCCCCCCOCCCCCCCCCCCC.OCCO

nearest known ligand 0.65

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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 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.65
KMT2A Q03164 2/20 0.65
THRB P10828 1/20 0.65
HTT P42858 1/20 0.65
MAPT P10636 1/20 0.65
CES2 O00748 2/20 0.61
TSHR P16473 4/20 0.54
USP2 O75604 1/20 0.47
NAAA Q02083 1/20 0.47
PLA2G2C Q5R387 2/20 0.46
HCAR2 Q8TDS4 1/20 0.44
LMNA P02545 2/20 0.44
ALDH1A1 P00352 1/20 0.44
HSD17B10 Q99714 1/20 0.44
EPHX1 P07099 1/20 0.44

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 SCHEMBL22445050 1.00 MEN1 (0.65) MEN1KMT2ATHRBHTTMAPT
Acetic Acid SCHEMBL896457 1.00 MEN1 (0.65) MEN1KMT2ATHRBHTTMAPT
Acetic Acid SCHEMBL22444982 1.00 MEN1 (0.65) MEN1KMT2ATHRBHTTMAPT
Acetic Acid SCHEMBL6435690 0.98 MEN1 (0.61) MEN1KMT2ATHRBHTTMAPT
Acetic Acid SCHEMBL2863329 0.93 CES2 (0.68) MEN1KMT2ATHRBHTTMAPT
Acetic Acid SCHEMBL4930252 0.93 CES2 (0.68) MEN1KMT2ATHRBHTTMAPT
Acetic Acid SCHEMBL537713 0.93 CES2 (0.68) MEN1KMT2ATHRBHTTMAPT
Acetic Acid SCHEMBL2400937 0.93 CES2 (0.68) MEN1KMT2ATHRBHTTMAPT
Acetic Acid SCHEMBL138223 0.93 CES2 (0.68) MEN1KMT2ATHRBHTTMAPT
Acetic Acid SCHEMBL3426392 0.93 CES2 (0.68) MEN1KMT2ATHRBHTTMAPT

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
EP-2450385-A1 BINDER RESIN FOR CONDUCTIVE PASTE, CONDUCTIVE PASTE, AND SOLAR CELL ELEMENT Sekisui Chemical Co., Ltd. (JP) 2012-05-09 EP disclosed
US-20120037223-A1 BINDER RESIN FOR CONDUCTIVE PASTE, CONDUCTIVE PASTE, AND SOLAR CELL ELEMENT SEKISUI CHEMICAL CO., LTD. (JP) 2012-02-16 US disclosed