Acetic Acid

Acetic Acid

SCHEMBL6509822

CC(=O)O.N=C(N)c1ccc(-c2cccc(-c3nc4cc(C(=N)N)ccc4[nH]3)c2O)cc1

nearest known ligand 0.68

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 13)

geneUniProtsupporting neighboursconfidence
F2 P00734 13/20 0.68
F10 P00742 13/20 0.68
PLG P00747 12/20 0.68
PLAU P00749 12/20 0.68
PLAT P00750 11/20 0.68
PRSS1 P07477 11/20 0.68
F9 P00740 1/20 0.68
F7 P08709 8/20 0.53
KLKB1 P03952 5/20 0.53
PRSS2 P07478 3/20 0.53
PRSS3 P35030 3/20 0.53
F3 P13726 2/20 0.50
HPN P05981 1/20 0.50

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
SCHEMBL5401443 0.93 F2 (0.73) F2F10PLGPLAUPLAT
SCHEMBL1302567 0.90 PLAU (0.83) F2F10PLGPLAUPLAT
SCHEMBL14519410 0.84 F2 (0.89) F2F10PLGPLAUPLAT
Acetic Acid SCHEMBL6061399 0.84 F2 (0.56) F2F10PLGPLAUPLAT
Acetic Acid SCHEMBL6509040 0.84 PLAU (0.53) F2F10PLGPLAUPLAT
Acetic Acid SCHEMBL6509121 0.84 PLAU (0.56) F2F10PLGPLAUPLAT
Acetic Acid SCHEMBL6505077 0.83 PLAU (0.53) F2F10PLGPLAUPLAT
SCHEMBL6061283 0.83 F2 (0.49) F2F10PLGPLAUPLAT
SCHEMBL6290365 0.83 F2 (0.71) F2F10PLGPLAUPLAT
Acetic Acid SCHEMBL5440440 0.83 PLAU (0.49) F2F10PLGPLAUPLAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050148646-A1 Dicationic triaryl analogs as anti-protozoan agents BOYKIN DAVID W (US) 2005-07-07 US 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-20050148646-A1 Dicationic triaryl analogs as anti-protozoan agents DDT, DDC, DARS1 F2 2666/4885F10 3872/4885PLG 1455/4885

“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.