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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.52 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.52 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.47 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | LCK | P06239 | 1/20 | 0.45 |
| ▸ | PPARD | Q03181 | 1/20 | 0.45 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.45 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.45 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.40 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.40 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.40 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.40 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL15793456 | 0.93 | GPR84 (0.58) | GPR84FFAR1FFAR4MAPTLCK | |
| Acetic Acid SCHEMBL11781078 | 0.91 | GPR84 (0.61) | GPR84FFAR1FFAR4MAPTLCK | |
| Acetic Acid SCHEMBL21598300 | 0.91 | GPR84 (0.61) | GPR84FFAR1FFAR4MAPTLCK | |
| Acetic Acid SCHEMBL28935333 | 0.91 | GPR84 (0.61) | GPR84FFAR1FFAR4MAPTLCK | |
| Acetic Acid SCHEMBL11782327 | 0.91 | GPR84 (0.61) | GPR84FFAR1FFAR4MAPTLCK | |
| Methoxymethane SCHEMBL3380929 | 0.89 | GPR84 (0.44) | GPR84FFAR1FFAR4ZDHHC7MAPT | |
| Ether SCHEMBL3382911 | 0.88 | GPR84 (0.48) | GPR84FFAR1FFAR4ZDHHC7MAPT | |
| Methoxymethane SCHEMBL966918 | 0.86 | GPR84 (0.48) | GPR84FFAR1FFAR4ZDHHC7MAPT | |
| Bicarbonate SCHEMBL154438 | 0.86 | GPR84 (0.60) | GPR84FFAR1FFAR4MAPTLCK | |
| Methoxymethane SCHEMBL965874 | 0.86 | GPR84 (0.48) | GPR84FFAR1FFAR4ZDHHC7MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2009070-B1 | Ink-jet ink and method of producing the same, color filter and method of producing the same, display device, and method of forming functional film | FUJIFILM CORP (JP) | 2010-11-24 | — | — | EP | disclosed |
| US-20090035535-A1 | INK-JET INK AND METHOD OF PRODUCING THE SAME, COLOR FILTER AND METHOD OF PRODUCING THE SAME, DISPLAY DEVICE, AND METHOD OF FORMING FUNCTIONAL FILM | FUJIFILM CORPORATION (JP) | 2009-02-05 | — | — | US | disclosed |
| EP-2009070-A1 | Ink-jet ink and method of producing the same, color filter and method of producing the same, display device, and method of forming functional film | FUJIFILM Corporation (JP) | 2008-12-31 | — | — | EP | disclosed |