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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 2/20 | 0.52 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.52 |
| ▸ | GPR84 | Q9NQS5 | 8/20 | 0.48 |
| ▸ | ACACB | O00763 | 1/20 | 0.43 |
| ▸ | ACACA | Q13085 | 1/20 | 0.43 |
| ▸ | FAAH | O00519 | 2/20 | 0.42 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 SCHEMBL7072443 | 0.92 | FFAR1 (0.61) | FFAR1FFAR4GPR84FAAHNFKB1 | |
| Acetic Acid SCHEMBL7075955 | 0.92 | FFAR1 (0.61) | FFAR1FFAR4GPR84FAAHNFKB1 | |
| Acetic Acid SCHEMBL7078004 | 0.91 | FFAR1 (0.59) | FFAR1FFAR4GPR84FAAHNFKB1 | |
| SCHEMBL10854443 | 0.88 | FFAR4 (0.42) | FFAR1FFAR4GPR84ACACBACACA | |
| Acetic Acid SCHEMBL7070635 | 0.86 | GPR84 (0.46) | FFAR1FFAR4GPR84ACACBACACA | |
| Acetic Acid SCHEMBL4019504 | 0.81 | FFAR1 (0.73) | FFAR1FFAR4GPR84FAAHNFKB1 | |
| Acetic Acid SCHEMBL28707278 | 0.81 | FFAR1 (0.73) | FFAR1FFAR4GPR84FAAHNFKB1 | |
| Acetic Acid SCHEMBL28392186 | 0.81 | FFAR1 (0.73) | FFAR1FFAR4GPR84FAAHNFKB1 | |
| SCHEMBL15254353 | 0.81 | FFAR1 (0.55) | FFAR1FFAR4GPR84FAAHNFKB1 | |
| Acetic Acid SCHEMBL29020019 | 0.81 | FFAR1 (0.73) | FFAR1FFAR4GPR84FAAHNFKB1 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2003052026-A1 | AN ANTIOXIDANT COMPOSITION | POLYINOVA AB (SE) | 2003-06-26 | — | — | WO | disclosed |