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 | |
|---|---|---|---|---|
| SCHEMBL12595 | 0.97 | — | — | |
| SCHEMBL6202698 | 0.97 | — | — | |
| SCHEMBL29567354 | 0.97 | — | — | |
| Methane SCHEMBL29230318 | 0.94 | — | — | |
| SCHEMBL28001103 | 0.94 | — | — | |
| SCHEMBL187175 | 0.94 | — | — | |
| Iodide SCHEMBL27679411 | 0.94 | — | — | |
| Bromide SCHEMBL28516239 | 0.94 | ACHE (0.58) | — | |
| Fluoride SCHEMBL27260184 | 0.94 | — | — | |
| Bromide SCHEMBL27781060 | 0.94 | — | — |
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-109964943-A | Herbicidal combinations and its application comprising pyrimidine formoxyl oxime compound | 江苏清原农冠杂草防治有限公司 | 2019-07-05 | — | — | CN | claimed |
| CN-109283276-A | Eight kinds of remaining gas chromatographies of phenoxy carboxylic acid herbicides in a kind of measurement corn | 丁立平 | 2019-01-29 | — | — | CN | claimed |
| CN-107897191-A | A kind of Herbicidal combinations of the fluorine of azoles containing benzene humulone and its application | 青岛清原化合物有限公司 | 2018-04-13 | — | — | CN | claimed |
| CN-110526412-A | The processing method of chromate waste water based on microdisk electrode | UNIV ZHEJIANG OCEAN | 2019-12-03 | — | — | CN | disclosed |
| CN-107936494-B | A kind of whole life cycle design masterbatch and preparation method thereof inhibiting weeds | 山东天野生物降解新材料科技有限公司 | 2019-10-11 | — | — | CN | disclosed |
| CN-107759993-B | It can inhibit the whole life cycle design masterbatch and preparation method thereof of weed growth | 山东天野生物降解新材料科技有限公司 | 2019-09-13 | — | — | CN | disclosed |
| CN-110028399-A | A kind of preparation method of 2-methyl-4-chlorophenoxyacetic acid | 上海泰禾国际贸易有限公司 | 2019-07-19 | — | — | CN | disclosed |
| CN-110003270-A | A kind of glyphosate dication type ion liquid compound and its preparation method and application | 浙江省农业科学院 | 2019-07-12 | — | — | CN | disclosed |
| CN-106062276-B | Compositions and methods for functionalizing and joining materials | 诺维信公司 | 2019-06-11 | — | — | CN | disclosed |
| CN-106068077-B | The composition and method of characteristic after harvest for improving crops | 诺维信公司 | 2019-06-07 | — | — | CN | disclosed |
| CN-109400568-A | 7- aroyl acetyl oxygroup isoflavone derivative and its application on pesticide | 江苏大学 | 2019-03-01 | — | — | CN | disclosed |
| CN-107903597-A | Suppress whole life cycle design of weeds and preparation method thereof | 山东天野生物降解新材料科技有限公司 | 2018-04-13 | — | — | CN | disclosed |
| CN-107759993-A | Whole life cycle design masterbatch of weed growth and preparation method thereof can be suppressed | 山东天野生物降解新材料科技有限公司 | 2018-03-06 | — | — | CN | disclosed |
| CN-107372503-A | A kind of MCPA,MCP,methoxone dimethylamine salt aqua of high concentration and preparation method thereof | 江苏省农垦生物化学有限公司 | 2017-11-24 | — | — | CN | disclosed |
| CN-104724872-B | The method that sodium chloride is reclaimed from the waste water of production phenoxy acetic acid class agricultural chemicals | 上海泰禾国际贸易有限公司 | 2017-09-15 | — | — | CN | disclosed |
| CN-105399715-B | Substituted phenoxy acetic acid class compound and preparation method and application | 中国农业大学 | 2017-08-29 | — | — | CN | disclosed |
| CN-106068077-A | The compositions of characteristic and method after the results improving crops | 诺维信公司 | 2016-11-02 | — | — | CN | disclosed |
| CN-106062271-A | Compositions and methods for improving properties of cellulosic textile materials having xyloglucan endotransglycosylase | 诺维信公司 | 2016-10-26 | — | — | CN | disclosed |
| CN-106062270-A | Compositions and methods for improving properties of non-cellulosic textile materials using xyloglucan endotransglycosylase | 诺维信公司 | 2016-10-26 | — | — | CN | disclosed |
| CN-106062276-A | Compositions and methods for functionalizing and joining materials | 诺维信公司 | 2016-10-26 | — | — | CN | disclosed |