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 | 1/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HMGCR | P04035 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | ARG1 | P05089 | 1/20 | 0.32 |
| ▸ | ARG2 | P78540 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL1052168 | 0.88 | ALDH1A1 (0.40) | ALDH1A1TSHRSLC7A5CYP1A2CYP2D6 | |
| Hydrogen Peroxide SCHEMBL10659944 | 0.87 | — | — | |
| Acetic Acid SCHEMBL3691254 | 0.85 | FFAR3 (0.44) | FFAR3LCKFYNALDH1A1TSHR | |
| SCHEMBL3644046 | 0.84 | — | — | |
| SCHEMBL144710 | 0.84 | — | — | |
| Lactic Acid SCHEMBL3820380 | 0.83 | TP53 (0.58) | ALDH1A1TSHRSLC7A5CYP1A2CYP2D6 | |
| Acetic Acid SCHEMBL1033678 | 0.82 | FFAR3 (0.41) | FFAR3LCKFYNALDH1A1TSHR | |
| Acetic Acid SCHEMBL28468783 | 0.81 | FFAR3 (0.47) | FFAR3LCKFYNALDH1A1TSHR | |
| SCHEMBL10643645 | 0.81 | ALDH1A1 (0.35) | ALDH1A1TSHRSLC7A5CYP1A2CYP2D6 | |
| Water SCHEMBL190438 | 0.81 | — | — |
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 61 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119798586-A | Preparation method of polyisocyanate composition | 万华化学集团股份有限公司 | 2025-04-11 | — | — | CN | claimed |
| CN-118165221-A | Allophanate composition, polyisocyanate composition, and preparation methods and applications thereof | 万华化学（宁波）有限公司 | 2024-06-11 | — | — | CN | claimed |
| CN-118165226-A | Preparation method of polyisocyanate composition | 万华化学（宁波）有限公司 | 2024-06-11 | — | — | CN | claimed |
| CN-113698572-B | Polyisocyanate composition, preparation method and application | 万华化学（宁波）有限公司 | 2023-12-19 | — | — | CN | claimed |
| CN-116854890-A | Preparation method of polyisocyanate composition | 万华化学集团股份有限公司 | 2023-10-10 | — | — | CN | claimed |
| CN-115246793-B | Preparation method of diisocyanate trimer, catalyst and preparation method thereof | 山东新和成精化科技有限公司 | 2023-07-07 | — | — | CN | claimed |
| CN-113265037-B | Polyisocyanate composition and preparation method and application thereof | 万华化学（宁波）有限公司 | 2023-03-24 | — | — | CN | claimed |
| WO-2022241616-A1 | POLYISOCYANATE COMPOSITION, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 万华化学（宁波）有限公司 | 2022-11-24 | — | — | WO | claimed |
| CN-113698572-A | Polyisocyanate composition, preparation method and application | 万华化学（宁波）有限公司 | 2021-11-26 | — | — | CN | claimed |
| CN-113265037-A | Polyisocyanate composition and preparation method and application thereof | 万华化学（宁波）有限公司 | 2021-08-17 | — | — | CN | claimed |
| CN-119798586-A | Preparation method of polyisocyanate composition | 万华化学集团股份有限公司 | 2025-04-11 | — | — | CN | disclosed |
| CN-118290706-A | Preparation method of polyisocyanate composition | 万华化学（宁波）有限公司 | 2024-07-05 | — | — | CN | disclosed |
| CN-118165227-A | Polyisocyanate composition with stable chromaticity after dilution and preparation method and application thereof | 万华化学集团股份有限公司 | 2024-06-11 | — | — | CN | disclosed |
| CN-118165226-A | Preparation method of polyisocyanate composition | 万华化学（宁波）有限公司 | 2024-06-11 | — | — | CN | disclosed |
| CN-118165221-A | Allophanate composition, polyisocyanate composition, and preparation methods and applications thereof | 万华化学（宁波）有限公司 | 2024-06-11 | — | — | CN | disclosed |
| WO-2008070060-A2 | DEVICE MANUFACTURING PROCESS UTILIZING A DOUBLE PATTERING PROCESS | FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) | 2008-06-12 | — | — | WO | disclosed |
| US-20070155894-A1 | Method for producing polyurethane emulsion for aqueous one-component coating agent | NIPPON POLYURETHANE INDUSTRY CO., LTD. | 2007-07-05 | — | — | US | disclosed |
| EP-1721947-A1 | PROCESS FOR PRODUCING POLYURETHANE EMULSION FOR WATER-BASED ONE-PACK TYPE COATING MATERIAL | Nippon Polyurethane Industry Co., Ltd. (JP) | 2006-11-15 | — | — | EP | disclosed |
| US-6596819-B2 | An isocyanate group-terminated prepolymer having isocyanurate group and urethane group, obtained by reacting an organic polyisocyanate containing at least (a1) an aromatic diisocyanate with an active hydrogen group-containing compound | NIPPON POLYURETHANE INDUSTRY CO., LTD. (JP) | 2003-07-22 | — | — | US | disclosed |
| US-20030083451-A1 | Polyisocyanate curing agent for laminate adhesive and process for production thereof | NIPPON POLYURETHANE INDUSTRY CO., LTD. (JP) | 2003-05-01 | — | — | US | disclosed |