Acetic Acid

Acetic Acid

SCHEMBL5555720

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nearest known ligand 0.44

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
NOS3 known ✓ P29474 1/20 0.37
NOS1 known ✓ P29475 1/20 0.37
ANPEP P15144 3/20 0.44
TDP1 Q9NUW8 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
PAOX Q6QHF9 3/20 0.35
GABRR1 P24046 2/20 0.33
CA12 O43570 2/20 0.33
CA6 P23280 2/20 0.33
CA7 P43166 2/20 0.33
CA9 Q16790 2/20 0.33
CA14 Q9ULX7 2/20 0.33
CA5B Q9Y2D0 2/20 0.33
RECQL P46063 1/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
LMNA P02545 2/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 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
Acetic Acid SCHEMBL5555716 1.00 ANPEP (0.44) ANPEPTDP1MEN1KMT2ANOS3
SCHEMBL8246840 0.88
SCHEMBL5160397 0.88
Hydrochloric Acid SCHEMBL2439875 0.86 ANPEP (0.47) ANPEPTDP1MEN1KMT2ANOS3
Hydrochloric Acid SCHEMBL16114150 0.86 ANPEP (0.47) ANPEPTDP1MEN1KMT2ANOS3
Acetic Acid SCHEMBL3421514 0.80 ANPEP (0.47) ANPEPTDP1MEN1KMT2APAOX
Hydrochloric Acid SCHEMBL7055449 0.78 UBE2N (0.48) ANPEPTDP1MEN1KMT2APAOX
Acetic Acid SCHEMBL3180181 0.78 ANPEP (0.44) ANPEPTDP1MEN1KMT2APAOX
Acetic Acid SCHEMBL28384916 0.78 ANPEP (0.44) ANPEPTDP1MEN1KMT2APAOX
Acetic Acid SCHEMBL3657736 0.76 CA12 (0.59) TDP1MEN1KMT2APAOXCA12

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7175829-B2 Contrast-enhanced diagnostic imaging method for monitoring interventional therapies EPIX PHARMACEUTICALS, INC. (US) 2007-02-13 US disclosed
US-20050118103-A1 Contrast-enhanced diagnostic imaging method for monitoring interventional therapies EPIX MEDICAL, INC., A DELAWARE CORPORATION 2005-06-02 US disclosed
US-6861045-B1 Contrast-enhanced diagnostic imaging method for monitoring interventional therapies LANTHEUS MEDICAL IMAGING, INC. 2005-03-01 US disclosed
EP-1019094-B1 CONTRAST-ENHANCED DIAGNOSTIC IMAGING METHOD FOR MONITORING INTERVENTIONAL THERAPIES EPIX MEDICAL INC (US) 2003-11-19 EP disclosed
EP-1021452-B1 PROCESS FOR SYNTHESIZING PHOSPHODIESTERS EPIX MEDICAL INC (US) 2003-04-02 EP disclosed
EP-1019094-A2 CONTRAST-ENHANCED DIAGNOSTIC IMAGING METHOD FOR MONITORING INTERVENTIONAL THERAPIES Epix Medical, Inc. (US) 2000-07-19 EP disclosed
US-5919967-A Process for synthesizing phosphodiesters EPIX MEDICAL, INC. (US) 1999-07-06 US disclosed
WO-1999017809-A2 CONTRAST-ENHANCED DIAGNOSTIC IMAGING METHOD FOR MONITORING INTERVENTIONAL THERAPIES EPIX MEDICAL, INC. (US) 1999-04-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050118103-A1 Contrast-enhanced diagnostic imaging method for monitoring interventional therapies FABP3, FABP1, SDCBP NOS3 4219/4885NOS1 4529/4885ANPEP 987/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.