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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR1 known ✓ | P30556 | 1/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 3/20 | 0.44 |
| ▸ | LCK | P06239 | 1/20 | 0.44 |
| ▸ | FYN | P06241 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
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 SCHEMBL6368562 | 0.97 | FFAR3 (0.47) | FFAR3LCKFYNCHRM2CHRM4 | |
| Acetic Acid SCHEMBL599872 | 0.97 | FFAR3 (0.47) | FFAR3LCKFYNCHRM2CHRM4 | |
| Acetic Acid SCHEMBL3884321 | 0.94 | FFAR3 (0.44) | FFAR3LCKFYNCHRM2CHRM4 | |
| Acetic Acid SCHEMBL16244302 | 0.94 | FFAR3 (0.50) | FFAR3LCKFYNCHRM2CHRM4 | |
| Acetic Acid SCHEMBL28549045 | 0.94 | FFAR3 (0.50) | FFAR3LCKFYNCHRM2CHRM4 | |
| Acetic Acid SCHEMBL22152 | 0.94 | FFAR3 (0.50) | FFAR3LCKFYNCHRM2CHRM4 | |
| Acetic Acid SCHEMBL28664565 | 0.94 | FFAR3 (0.50) | FFAR3LCKFYNCHRM2CHRM4 | |
| Acetic Acid SCHEMBL19356582 | 0.94 | FFAR3 (0.50) | FFAR3LCKFYNCHRM2CHRM4 | |
| Acetic Acid SCHEMBL31218573 | 0.94 | FFAR3 (0.50) | FFAR3LCKFYNCHRM2CHRM4 | |
| Acetic Acid SCHEMBL28289424 | 0.94 | FFAR3 (0.50) | FFAR3LCKFYNCHRM2CHRM4 |
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-1177789-C | Method for preparing hinokitiol | 旭化成株式会社 | 2004-12-01 | — | — | CN | disclosed |
| EP-1069104-B1 | PROCESS FOR PRODUCING HINOKITIOL | ASAHI CHEMICAL IND (JP) | 2004-01-28 | — | — | EP | disclosed |
| CN-1291970-A | Process for producing hinokitiol | ASAHI CHEMICAL IND (JP) | 2001-04-18 | — | — | CN | disclosed |
| EP-1069104-A1 | PROCESS FOR PRODUCING HINOKITIOL | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 2001-01-17 | — | — | EP | disclosed |