Acetic Acid

Acetic Acid

SCHEMBL28988950

CC(=O)O.CCCCC1CCCOO1

nearest known ligand 0.38

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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 10)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.38
POLB P06746 2/20 0.34
HPGD P15428 1/20 0.34
CYP1A2 P05177 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
USP2 O75604 1/20 0.32

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
SCHEMBL8428841 0.89 EPHX1 (0.45) EPHX1CYP1A2SMN1; SMN2ALDH1A1
SCHEMBL12096491 0.84 EPHX1 (0.53) EPHX1CYP1A2SMN1; SMN2KMT2AALDH1A1
Acetic Acid SCHEMBL4544293 0.83 EPHX1 (0.50) EPHX1CYP1A2KMT2AALDH1A1
SCHEMBL5697977 0.82 EPHX1 (0.57) EPHX1CYP1A2KMT2AALDH1A1
SCHEMBL28042955 0.82 EPHX1 (0.57) EPHX1CYP1A2KMT2AALDH1A1
SCHEMBL27650515 0.82 EPHX1 (0.57) EPHX1CYP1A2KMT2AALDH1A1
SCHEMBL3271036 0.82 EPHX1 (0.57) EPHX1CYP1A2KMT2AALDH1A1
SCHEMBL9419418 0.82 EPHX1 (0.57) EPHX1CYP1A2KMT2AALDH1A1
SCHEMBL1111026 0.82 CYP1A2 (0.47) EPHX1CYP1A2ALDH1A1
SCHEMBL7019567 0.79 ALDH1A1 (0.41) POLBHPGDCYP1A2SMN1; SMN2KMT2A

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-115832607-B Preparation method of battery diaphragm, battery diaphragm and secondary battery 宁德时代新能源科技股份有限公司 2024-10-18 CN claimed
CN-115832607-A Preparation method of battery diaphragm, battery diaphragm and secondary battery 宁德时代新能源科技股份有限公司 2023-03-21 CN claimed
CN-115832607-B Preparation method of battery diaphragm, battery diaphragm and secondary battery 宁德时代新能源科技股份有限公司 2024-10-18 CN disclosed
CN-115832607-A Preparation method of battery diaphragm, battery diaphragm and secondary battery 宁德时代新能源科技股份有限公司 2023-03-21 CN disclosed