Known targets — ChEMBL curated mechanism
ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO
The experimentally established mechanism targets of Water. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
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 | |
|---|---|---|---|---|
| Water SCHEMBL10504589 | 1.00 | — | — | |
| SCHEMBL317361 | 0.96 | — | — | |
| Water SCHEMBL5027092 | 0.96 | — | — | |
| SCHEMBL293298 | 0.91 | — | — | |
| SCHEMBL8916955 | 0.87 | — | — | |
| Ammonia Solution, Strong SCHEMBL11211491 | 0.87 | — | — | |
| SCHEMBL29657106 | 0.87 | — | — | |
| SCHEMBL18577710 | 0.87 | — | — | |
| SCHEMBL28680101 | 0.87 | — | — | |
| SCHEMBL2288105 | 0.87 | — | — |
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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2025127111-A1 | BINDER COMPOSITION FOR NEGATIVE ELECTRODES, NEGATIVE ELECTRODE FOR SECONDARY BATTERIES, AND SECONDARY BATTERY | ＡＧＣ株式会社 | 2025-06-19 | — | — | WO | disclosed |
| CN-120164946-A | Binder composition for negative electrode, negative electrode for secondary battery, and secondary battery | ＡＧＣ株式会社 | 2025-06-17 | — | — | CN | disclosed |
| CN-110983315-A | Aqueous metal surface treatment agent, metal surface treatment film, and metal material having metal surface treatment film | 日本帕卡濑精株式会社 | 2020-04-10 | — | — | CN | disclosed |
| CN-104726855-A | Aqueous metal surface treatment agent, metal surface treatment film, and metal material having metal surface treatment film | NIHON PARKERIZING | 2015-06-24 | — | — | CN | disclosed |
| US-9006315-B2 | Thermoplastic starch compositions | THE PROCTER & GAMBLE CO (US) | 2015-04-14 | — | — | US | disclosed |
| CN-102803319-B | Copolymer and cement dispersant comprising the copolymer | TOHO CHEM IND CO LTD | 2014-12-24 | — | — | CN | disclosed |
| US-20140275356-A1 | Thermoplastic Starch Compositions | THE PROCTER & GAMBLE COMPANY (US) | 2014-09-18 | — | — | US | disclosed |
| US-8835585-B2 | Copolymer and cement dispersant including the copolymer | TOHO CHEMICAL INDUSTRY CO., LTD. (JP) | 2014-09-16 | — | — | US | disclosed |
| US-20130018162-A1 | COPOLYMER AND CEMENT DISPERSANT INCLUDING THE COPOLYMER | TOHO CHEMICAL INDUSTRY CO., LTD. (JP) | 2013-01-17 | — | — | US | disclosed |
| CN-101052628-B | Isoxazoline derivatives and herbicidal use thereof | SYNGENTA LTD | 2011-07-27 | — | — | CN | disclosed |
| US-20070260046-A1 | Dispersant Using Kraft Lignin and Novel Lignin Derivative | NIPPON SHOKUBAI CO., LTD. (JP) | 2007-11-08 | — | — | US | disclosed |
| CN-101052628-A | Isoxazolines derivatives and its weedicide application | ZENECA LTD (GB) | 2007-10-10 | — | — | CN | disclosed |
| WO-2007101048-A2 | POLYMERIZABLE SILICONE COPOLYOL MACROMERS AND POLYMERS MADE THEREFROM | LUBRIZOL ADVANCED MATERIALS, INC. (US) | 2007-09-07 | — | — | WO | disclosed |
| EP-1829839-A1 | POWDERY POLYCARBOXYLIC-ACID CEMENT DISPERSANT AND DISPERSANT COMPOSITION CONTAINING THE DISPERSANT | Sika Ltd. (JP) | 2007-09-05 | — | — | EP | disclosed |
| US-20070039516-A1 | CEMENT DISPERSANT AND CONCRETE COMPOSITION CONTAINING THE DISPERSANT | SIKA LTD. (JP) | 2007-02-22 | — | — | US | disclosed |
| US-20070039515-A1 | Cement dispersant and concrete composition contain the dispersant | TOHO CHEMICAL INDUSTRY CO., LTD. (JP) | 2007-02-22 | — | — | US | disclosed |
| EP-1693353-A1 | CEMENT DISPERSANT AND CONCRETE COMPOSITION CONTAINING THE DISPERSANT | Sika Ltd. (JP) | 2006-08-23 | — | — | EP | disclosed |
| CN-1821149-A | Cement admixture and method for producing the same | NIPPON CATALYTIC CHEM IND (JP) | 2006-08-23 | — | — | CN | disclosed |
| EP-1669332-A1 | CEMENT DISPERSANT AND CONCRETE COMPOSITION CONTAINING THE DISPERSANT | Sika Ltd. (JP) | 2006-06-14 | — | — | EP | disclosed |
| WO-2006033464-A1 | DISPERSANT USING KRAFT LIGNIN AND NOVEL LIGNIN DERIVATIVE | NIPPON SHOKUBAI CO., LTD. (JP) | 2006-03-30 | — | — | WO | disclosed |