Acetic Acid

Acetic Acid

SCHEMBL10698023

CC(=O)O.Cn1ccc2ccccc21

nearest known ligand 0.58

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
NOTUM Q6P988 1/20 0.58
MAPK1 P28482 2/20 0.50
KMT2A Q03164 2/20 0.50
TSHR P16473 2/20 0.50
RAB9A P51151 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
LMNA P02545 2/20 0.46
MCL1 Q07820 1/20 0.46
CDK4 P11802 3/20 0.45
CCND1 P24385 3/20 0.45
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C19 P33261 1/20 0.43
CA12 O43570 1/20 0.42
BRD4 O60885 1/20 0.42
BRPF1 P55201 1/20 0.42
CA9 Q16790 1/20 0.42
KAT2B Q92831 1/20 0.42
BRD9 Q9H8M2 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL3117662 0.88 NOTUM (0.53) NOTUMMAPK1KMT2ATSHRRAB9A
SCHEMBL29384135 0.87 CDK4 (0.56) NOTUMCDK4CCND1CA12BRD4
SCHEMBL29812 0.87 CDK4 (0.56) NOTUMCDK4CCND1CA12BRD4
SCHEMBL7505128 0.87 MAPK1 (0.54) NOTUMMAPK1KMT2ATSHRRAB9A
Formaldehyde SCHEMBL27911684 0.85 CDK4 (0.50) NOTUMMAPK1KMT2ATSHRRAB9A
Bromide SCHEMBL6480413 0.85 CDK4 (0.54) NOTUMCDK4CCND1CA12BRD4
Bromide SCHEMBL31591097 0.85 CDK4 (0.54) NOTUMCDK4CCND1CA12BRD4
Hydrochloric Acid SCHEMBL30610362 0.85 CDK4 (0.54) NOTUMCDK4CCND1CA12BRD4
Hydrochloric Acid SCHEMBL1356443 0.85 CDK4 (0.54) NOTUMCDK4CCND1CA12BRD4
SCHEMBL3867839 0.84 NOTUM (0.48) NOTUMMAPK1KMT2ATSHRRAB9A

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-120004784-A New method for preparing aromatic aldehyde compound 广东海洋大学 2025-05-16 CN disclosed
CN-115286625-B Glutaminase allosteric site covalent inhibitor and preparation method and application thereof 浙江工业大学 2025-03-25 CN disclosed
CN-115286625-A Glutaminase allosteric site covalent inhibitor and preparation method and application thereof 浙江工业大学 2022-11-04 CN disclosed
EP-0268429-A2 Photoinitiator composition MORTON INTERNATIONAL, INC. (US) 1988-05-25 EP disclosed