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 | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 7/20 | 0.48 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
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 SCHEMBL4093239 | 1.00 | EPHX1 (0.48) | EPHX1FFAR3LCKFYNCES2 | |
| Acetic Acid SCHEMBL4087167 | 1.00 | EPHX1 (0.48) | EPHX1FFAR3LCKFYNCES2 | |
| Methylcyclopentane SCHEMBL4087874 | 0.97 | EPHX1 (0.44) | EPHX1FFAR3LCKFYNCES2 | |
| Methylcyclopentane SCHEMBL4362497 | 0.97 | EPHX1 (0.44) | EPHX1FFAR3LCKFYNCES2 | |
| Acetone SCHEMBL9529315 | 0.91 | EPHX1 (0.50) | EPHX1CES2CES1KMT2ARECQL | |
| Bicarbonate SCHEMBL17847302 | 0.91 | EPHX1 (0.50) | EPHX1CES2CES1CYP1A2KMT2A | |
| Bicarbonate SCHEMBL4695324 | 0.91 | EPHX1 (0.50) | EPHX1CES2CES1CYP1A2KMT2A | |
| Bicarbonate SCHEMBL8913592 | 0.91 | EPHX1 (0.50) | EPHX1CES2CES1CYP1A2KMT2A | |
| Acetic Acid SCHEMBL28484765 | 0.88 | EPHX1 (0.41) | EPHX1FFAR3LCKFYNCES2 | |
| Acetic Acid SCHEMBL28243885 | 0.88 | EPHX1 (0.41) | EPHX1FFAR3LCKFYNCES2 |
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 65 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118851098-A | Regeneration extraction method of waste alumina adsorption working solution in hydrogen peroxide regeneration system | 平湖石化有限责任公司 | 2024-10-29 | — | — | CN | claimed |
| CN-108350014-A | Aminoglycoside derivatives and their use in the treatment of genetic disorders | ELOXX制药有限公司 | 2018-07-31 | — | — | CN | claimed |
| CN-104495756-B | The anthraquinone method for hydrogenation preparing hydrogen peroxide | 江苏三鼎石化科技有限公司 | 2016-11-30 | — | — | CN | claimed |
| CN-104495756-A | Hydrogenation method for preparing hydrogen peroxide by adopting anthraquinone process | JIANGSU SANDING PETROCHEMICAL TECHNOLOGY CO LTD | 2015-04-08 | — | — | CN | claimed |
| CN-102174154-A | Binder resin and ink composition for roll printing comprising the same | LG CHEMICAL LTD | 2011-09-07 | — | — | CN | claimed |
| CN-101899136-A | Modified phenolic resin and application thereof in anti-corrosive paint | CAS GUANGZHOU HUAGUAN ENGINEERING CO LTD | 2010-12-01 | — | — | CN | claimed |
| JP-4216713-B2 | — | — | 2009-01-28 | — | — | JP | claimed |
| EP-1404324-A4 | PRODRUGS OF GABA ANALOGS, COMPOSITIONS AND USES THEREOF | XENOPORT INC (US) | 2004-12-22 | — | — | EP | claimed |
| JP-2004536873-A | — | — | 2004-12-09 | — | — | JP | claimed |
| EP-1404324-A2 | PRODRUGS OF GABA ANALOGS, COMPOSITIONS AND USES THEREOF | Xenoport, Inc. (US) | 2004-04-07 | — | — | EP | claimed |
| WO-2002100347-A2 | PRODRUGS OF GABA ANALOGS, COMPOSITIONS AND USES THEREOF | XENOPORT, INC. (US) | 2002-12-19 | — | — | WO | claimed |
| CN-118851098-A | Regeneration extraction method of waste alumina adsorption working solution in hydrogen peroxide regeneration system | 平湖石化有限责任公司 | 2024-10-29 | — | — | CN | disclosed |
| CN-117377674-A | Pyrazolo [1,5-a ] pyrimidine compounds for the treatment of dermatological disorders | 大塚制药株式会社 | 2024-01-09 | — | — | CN | disclosed |
| CN-106431850-B | Method for preparing epoxy compound ring-opening product by using micro-reaction device | 南京工业大学 | 2019-04-16 | — | — | CN | disclosed |
| CN-106629622-B | A kind of method for hydrogenation and hydrogenation apparatus of hydrogeneous anthraquinone working solution | 中触媒新材料股份有限公司 | 2019-02-22 | — | — | CN | disclosed |
| WO-2002100347-A2 | PRODRUGS OF GABA ANALOGS, COMPOSITIONS AND USES THEREOF | XENOPORT, INC. (US) | 2002-12-19 | — | — | WO | disclosed |
| CN-1296460-A | Process for the manufacturing of hydrogen peroxide | SOLVAY (BE) | 2001-05-23 | — | — | CN | disclosed |
| CN-1288462-A | Oxazolidinone combinatorial libraries, compositions and method of prepn. | UPJOHN CO (US) | 2001-03-21 | — | — | CN | disclosed |
| CN-1214710-A | Porous film, process for producing the same, and laminate films and recording sheets made with the use porous film | DAICEL CHEM (JP) | 1999-04-21 | — | — | CN | disclosed |
| EP-0237189-A2 | Therapeutic and related uses of dithiol peptides | REPLIGEN CORPORATION (US) | 1987-09-16 | — | — | EP | disclosed |