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.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Acetone SCHEMBL28961744 | 0.88 | — | — | |
| Bicarbonate SCHEMBL31013481 | 0.84 | — | — | |
| Acetic Acid SCHEMBL4649683 | 0.80 | FFAR3 (0.58) | — | |
| Acetic Acid SCHEMBL195596 | 0.80 | — | — | |
| Acetic Acid SCHEMBL28511653 | 0.77 | — | — | |
| Acetic Acid SCHEMBL10483716 | 0.77 | FFAR3 (0.54) | — | |
| Acetic Acid SCHEMBL28228255 | 0.75 | — | — | |
| Acetic Acid SCHEMBL4146177 | 0.75 | — | — | |
| Acetic Acid SCHEMBL7359120 | 0.74 | — | — | |
| Acetic Acid SCHEMBL29039833 | 0.74 | FFAR3 (0.78) | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102875610-A | Method for preparing 2-acetamido-2-deoxy-3, 4, 6-triacetyl-beta-D-chloro pyranoglucose | HUAIHAI INST TECHNOLOGY | 2013-01-16 | — | — | CN | disclosed |
| US-20080153872-A1 | Bis-(Coumarin) Compounds With Anti-Inflammatory Activity | PLIVA-ISTRAZIVACKI INSTITUT D.O.O. (HR) | 2008-06-26 | — | — | US | disclosed |
| EP-1846387-A2 | BIS-(COUMARIN) COMPOUNDS WITH ANTI-INFLAMMATORY ACTIVITY | GlaxoSmithKline istrazivacki centar Zagreb d.o.o. (HR) | 2007-10-24 | — | — | EP | disclosed |
| WO-2006111858-A2 | BIS-(COUMARIN) COMPOUNDS WITH ANTI-INFLAMMATORY ACTIVITY | GLAXOSMITHKLINE ISTRAZIVACKI CENTAR ZAGREB D.O.O. (US) | 2006-10-26 | — | — | WO | disclosed |