Acetic Acid

Acetic Acid

SCHEMBL28995037

CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(CNCc1ccccc1)NCCN.N=C=S

nearest known ligand 0.40

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
▸ OPRK1 known ✓ P41145 1/20 0.36
▸ ANPEP P15144 2/20 0.40
▸ ALDH1A1 P00352 3/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SIGMAR1 Q99720 2/20 0.38
▸ CYP1A2 P05177 2/20 0.37
▸ CYP2D6 P10635 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ MME P08473 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ BCHE P06276 2/20 0.36
▸ ATM Q13315 1/20 0.36
▸ RNPEP Q9H4A4 1/20 0.36
▸ DNPEP Q9ULA0 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36

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 SCHEMBL27982197 0.92 ANPEP (0.46) ANPEPALDH1A1MEN1MAPTKMT2A
SCHEMBL28134518 0.85 SIGMAR1 (0.47) ANPEPALDH1A1MEN1MAPTKMT2A
Acetic Acid SCHEMBL27901200 0.84 MAOA (0.47) ALDH1A1MEN1MAPTKMT2ASIGMAR1
Acetic Acid SCHEMBL27962834 0.83 MAOA (0.46) ALDH1A1MEN1MAPTKMT2ASIGMAR1
Acetic Acid SCHEMBL27962848 0.83 MAOA (0.46) ALDH1A1MEN1MAPTKMT2ASIGMAR1
Acetic Acid SCHEMBL29156192 0.82 P2RY6 (0.36) ANPEPALDH1A1MEN1KMT2ACYP1A2
Acetic Acid SCHEMBL28375367 0.82 KMT2A (0.49) ALDH1A1MEN1KMT2ASIGMAR1SMN1; SMN2
Acetic Acid SCHEMBL29156189 0.80 TSHR (0.38) ANPEPALDH1A1MEN1KMT2ACYP1A2
Acetic Acid SCHEMBL8076699 0.78 OPRD1 (0.36) MEN1KMT2ASIGMAR1OPRK1
Acetic Acid SCHEMBL8540399 0.75 MEN1 (0.57) ALDH1A1MEN1MAPTKMT2ASIGMAR1

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
CN-116041529-A anti-CD 3 antibodies and methods of use 基因泰克公司 2023-05-02 — — CN disclosed
CN-109608545-A The anti-HER4 antibody of same type specificity 健泰科生物技术公司 2019-04-12 — — CN disclosed
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