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 | |
|---|---|---|---|---|
| SCHEMBL67968 | 0.97 | — | — | |
| SCHEMBL27968456 | 0.93 | — | — | |
| Fluoride SCHEMBL29655462 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL28181815 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL5702841 | 0.93 | TSHR (0.37) | — | |
| SCHEMBL9718210 | 0.93 | TSHR (0.37) | — | |
| Ammonia Solution, Strong SCHEMBL28586237 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL7937814 | 0.93 | TSHR (0.37) | — | |
| SCHEMBL28535293 | 0.90 | TSHR (0.36) | — | |
| Hydrochloric Acid SCHEMBL5165959 | 0.90 | TSHR (0.35) | — |
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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109852214-A | A kind of corrosion resistant spray polyurea and preparation method thereof | 李鸿翔 | 2019-06-07 | — | — | CN | claimed |
| CN-110392715-A | Polyester polymer composition | 塞拉尼斯销售德国有限公司 | 2019-10-29 | — | — | CN | disclosed |
| CN-110312764-A | Soil release coat system | PPG涂料欧洲有限责任公司 | 2019-10-08 | — | — | CN | disclosed |
| CN-109971343-B | A kind of abrasion-proof insulating material and its preparation method and application coated on overhead bare conductor | 广东冠能电力科技发展有限公司 | 2019-09-03 | — | — | CN | disclosed |
| CN-110177848-A | Double-faced adhesive tape | 积水化学工业株式会社 | 2019-08-27 | — | — | CN | disclosed |
| CN-105969177-B | A kind of coating composition and the preparation method and application thereof | 中国民用航空总局第二研究所 | 2019-08-27 | — | — | CN | disclosed |
| CN-110167973-A | High purity polypropylene and polypropene composition for molding | 道达尔研究技术弗吕公司 | 2019-08-23 | — | — | CN | disclosed |
| CN-109971343-A | A kind of abrasion-proof insulating material and its preparation method and application coated on overhead bare conductor | 广东冠能电力科技发展有限公司 | 2019-07-05 | — | — | CN | disclosed |
| CN-106687508-B | Organic silicon emulsion | 美国陶氏有机硅公司 | 2019-06-14 | — | — | CN | disclosed |
| CN-109867594-A | The method that alcohol is obtained by aldehyde | 赢创德固赛有限公司 | 2019-06-11 | — | — | CN | disclosed |
| CN-107923995-A | Adhesion characteristic with optimization and the article for including silicon organic layer | 依视路国际公司 | 2018-04-17 | — | — | CN | disclosed |
| CN-107848229-A | For the method for being laminated the interference coatings for including organic/inorganic layer and thus obtained article | 依视路国际公司 | 2018-03-27 | — | — | CN | disclosed |
| CN-107848877-A | Include the article of organic inorganic layer with improved thermo-mechanical property | 依视路国际公司 | 2018-03-27 | — | — | CN | disclosed |
| CN-105378013-B | Articles comprising pressure sensitive adhesive tapes | 3M创新有限公司 | 2017-11-03 | — | — | CN | disclosed |
| CN-106687508-A | Silicone emulsions | 道康宁公司 | 2017-05-17 | — | — | CN | disclosed |
| CN-106459098-A | Monoaminosilane compounds | 道康宁公司 | 2017-02-22 | — | — | CN | disclosed |
| CN-106398531-A | Composite material with excellent elasticity and adhesiveness, and preparation method thereof | 安徽天瞳智能科技有限公司 | 2017-02-15 | — | — | CN | disclosed |
| CN-106414462-A | Diaminosilane compounds | 道康宁公司 | 2017-02-15 | — | — | CN | disclosed |
| CN-102112397-B | A kind of novel molecular sieve composition EMM 12, its preparation method and using method | 埃克森美孚化学专利公司 | 2016-12-21 | — | — | CN | disclosed |
| CN-103833046-B | Use the method that EMM-13 prepares Alkylaromatics | 埃克森美孚化学专利公司 | 2016-10-05 | — | — | CN | disclosed |