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)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GNAI3 | P08754 | 9/20 | 0.42 |
| ▸ | GNAO1 | P09471 | 9/20 | 0.42 |
| ▸ | GNAI1 | P63096 | 9/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | CPN1 | P15169 | 1/20 | 0.38 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | LCK | P06239 | 1/20 | 0.38 |
| ▸ | PPARD | Q03181 | 1/20 | 0.38 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.38 |
| ▸ | ZDHHC2 | Q9UIJ5 | 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 SCHEMBL29252518 | 0.91 | GNAI3 (0.42) | GNAI3GNAO1GNAI1EPHX1GPR84 | |
| SCHEMBL23114622 | 0.84 | GNAO1 (0.42) | GNAI3GNAO1GNAI1EPHX1 | |
| SCHEMBL19102992 | 0.84 | GNAO1 (0.42) | GNAI3GNAO1GNAI1EPHX1 | |
| SCHEMBL20306106 | 0.84 | GNAO1 (0.46) | GNAI3GNAO1GNAI1EPHX1 | |
| SCHEMBL20626600 | 0.84 | GNAO1 (0.46) | GNAI3GNAO1GNAI1EPHX1 | |
| SCHEMBL18922334 | 0.84 | GNAO1 (0.46) | GNAI3GNAO1GNAI1EPHX1 | |
| SCHEMBL20004243 | 0.84 | GNAO1 (0.46) | GNAI3GNAO1GNAI1EPHX1 | |
| SCHEMBL13825689 | 0.84 | GNAO1 (0.38) | GNAI3GNAO1GNAI1EPHX1CPN1 | |
| SCHEMBL18557836 | 0.84 | GNAO1 (0.46) | GNAI3GNAO1GNAI1EPHX1 | |
| SCHEMBL20093568 | 0.84 | GNAO1 (0.46) | GNAI3GNAO1GNAI1EPHX1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117999475-A | Electrochemical gas sensor and electrolyte for electrochemical gas sensor | 德尔格安全股份两合公司 | 2024-05-07 | — | — | CN | disclosed |