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 | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 2/20 | 0.78 |
| ▸ | LCK | P06239 | 1/20 | 0.78 |
| ▸ | FYN | P06241 | 1/20 | 0.78 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | THPO | P40225 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | MMP12 | P39900 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | SLC15A2 | Q16348 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
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 SCHEMBL4905548 | 1.00 | — | — | |
| Acetic Acid SCHEMBL27599360 | 0.95 | FFAR3 (0.70) | FFAR3LCKFYNLMNATSHR | |
| Acetic Acid SCHEMBL27903413 | 0.95 | — | — | |
| Acetic Acid SCHEMBL15024006 | 0.95 | — | — | |
| Acetic Acid SCHEMBL28953560 | 0.95 | — | — | |
| Acetic Acid SCHEMBL28281801 | 0.95 | — | — | |
| Acetic Acid SCHEMBL9681158 | 0.95 | FFAR3 (0.70) | FFAR3LCKFYNLMNATSHR | |
| Acetic Acid SCHEMBL29006244 | 0.95 | FFAR3 (0.70) | FFAR3LCKFYNLMNATSHR | |
| Acetic Acid SCHEMBL11421641 | 0.94 | FFAR3 (0.88) | FFAR3LCKFYNLMNATSHR | |
| Acetic Acid SCHEMBL133667 | 0.94 | FFAR3 (0.88) | FFAR3LCKFYNLMNATSHR |
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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108658741-B | Preparation method of avobenzone | 宿迁科思化学有限公司 | 2022-01-11 | — | — | CN | claimed |
| CN-108530285-B | Preparation and post-treatment method of p-tert-butyl benzoic acid | 宿迁科思化学有限公司 | 2021-09-28 | — | — | CN | claimed |
| CN-117924070-A | Method for preparing benzoic acid by catalyzing toluene oxidation | 湖南松源生物科技有限公司 | 2024-04-26 | — | — | CN | disclosed |
| CN-116789548-A | Recovery process of thionyl chloride by reaction of m-phthaloyl chloride and p-phthaloyl chloride | 宁夏丰华生物科技有限公司 | 2023-09-22 | — | — | CN | disclosed |
| US-11677071-B2 | Lithium battery cathode | NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) | 2023-06-13 | — | — | US | disclosed |
| CN-108658741-B | Preparation method of avobenzone | 宿迁科思化学有限公司 | 2022-01-11 | — | — | CN | disclosed |
| CN-108530285-B | Preparation and post-treatment method of p-tert-butyl benzoic acid | 宿迁科思化学有限公司 | 2021-09-28 | — | — | CN | disclosed |
| US-20200251727-A1 | LITHIUM BATTERY CATHODE | NAT TECH & ENG SOLUTIONS SANDIA LLC (US) | 2020-08-06 | — | — | US | disclosed |
| US-10651461-B2 | Lithium battery cathode | NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) | 2020-05-12 | — | — | US | disclosed |
| CN-110642713-A | Preparation method of terephthalic acid | 王小桥 | 2020-01-03 | — | — | CN | disclosed |
| US-10411251-B2 | Lithium battery cathode | NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) | 2019-09-10 | — | — | US | disclosed |
| CN-107759460-A | A kind of method for preparing the more acid monomers of polyphenyls | 朱翠英 | 2018-03-06 | — | — | CN | disclosed |
| CN-106467466-A | A kind of preparation method of cyclohexene-Isosorbide-5-Nitrae-dicarboxylate | 中国科学院大连化学物理研究所 | 2017-03-01 | — | — | CN | disclosed |
| CN-104667789-B | PTA refined unit high efficiency agitation tank | 逸盛大化石化有限公司 | 2017-01-04 | — | — | CN | disclosed |
| CN-104667791-A | Stirring tank for high-temperature and high-pressure crystallization system of PTA (pure terephthalic acid) refining unit | YISHENG DAHUA PETROCHEMICAL CO LTD | 2015-06-03 | — | — | CN | disclosed |
| CN-104667789-A | Efficient stirring tank for PTA (pure terephthalic acid) refining unit | YISHENG DAHUA PETROCHEMICAL CO LTD | 2015-06-03 | — | — | CN | disclosed |
| US-20150118565-A1 | LITHIUM BATTERY CATHODE | THE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2015-04-30 | — | — | US | disclosed |
| CN-203620552-U | Agitation tank for high temperature and high pressure crystallization system of PTA (pure terephthalic acid) refining unit | YISHENG DAHUA PETROCHEMICAL CO LTD | 2014-06-04 | — | — | CN | disclosed |
| CN-203620550-U | Efficient agitation tank for PTA (pure terephthalic acid) refining unit | YISHENG DAHUA PETROCHEMICAL CO LTD | 2014-06-04 | — | — | CN | disclosed |
| WO-2013169223-A1 | LITHIUM BATTERY CATHODE | SANDIA CORPORATION (US) | 2013-11-14 | — | — | WO | disclosed |