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 SCHEMBL27469648 | 1.00 | — | — | |
| Water SCHEMBL28801943 | 1.00 | — | — | |
| Water SCHEMBL11784306 | 0.87 | — | — | |
| Water SCHEMBL28033227 | 0.87 | — | — | |
| Water SCHEMBL11784309 | 0.87 | — | — | |
| Water SCHEMBL94343 | 0.82 | — | — | |
| Water SCHEMBL11845423 | 0.82 | — | — | |
| Water SCHEMBL5802169 | 0.82 | — | — | |
| Water SCHEMBL8153667 | 0.82 | — | — | |
| Water SCHEMBL2299753 | 0.82 | — | — |
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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118325093-A | Method for preparing raw phenyl silicone rubber by one-pot method | 江西蓝星星火有机硅有限公司 | 2024-07-12 | — | — | CN | claimed |
| CN-105778104-B | A kind of add-on type liquid fluorine silicon rubber base glue and preparation method thereof | 威海新元化工有限公司 | 2018-08-24 | — | — | CN | claimed |
| CN-105778104-A | Addition type liquid fluorinated silicone rubber base rubber and preparation method thereof | 威海新元化工有限公司 | 2016-07-20 | — | — | CN | claimed |
| CN-104327268-A | Siloxane copolymer containing ethyl phenyl silica chain links and preparation method thereof | UNIV HANGZHOU NORMAL | 2015-02-04 | — | — | CN | claimed |
| CN-120157122-A | Method for reducing and purifying graphite alkali-melting silicon-removing sodium hydroxide | 黑龙江科技大学 | 2025-06-17 | — | — | CN | disclosed |
| CN-118325093-A | Method for preparing raw phenyl silicone rubber by one-pot method | 江西蓝星星火有机硅有限公司 | 2024-07-12 | — | — | CN | disclosed |
| CN-114381001-B | Preparation method of solvent-resistant fluorosilicone rubber with wide temperature range and composition thereof | 山东华夏神舟新材料有限公司 | 2023-06-23 | — | — | CN | disclosed |
| CN-114381001-A | Preparation method of wide-temperature-range solvent-resistant fluorosilicone rubber and composition thereof | 山东华夏神舟新材料有限公司 | 2022-04-22 | — | — | CN | disclosed |
| CN-110156826-B | Diphenyl cyclotrisiloxane and preparation method and application thereof | WEIHAI NEWERA CHEMICAL CO.,LTD. (CN) | 2021-08-31 | — | — | CN | disclosed |
| CN-110156826-A | Diphenyl cyclotrisiloxane and the preparation method and application thereof | 威海新元化工有限公司 | 2019-08-23 | — | — | CN | disclosed |
| CN-104761912-B | A kind of damping silicon rubber with smaller temperature effect and preparation method thereof | 山东大学 | 2017-11-07 | — | — | CN | disclosed |
| CN-107151551-A | A kind of three-phase nanoemulsions with core shell structure and its preparation method and application | 中国石油化工股份有限公司 | 2017-09-12 | — | — | CN | disclosed |
| CN-103391711-A | Plant growth method and silicon-rich foliage plant | TAKENAKA GARDEN AFFORESTATION INC | 2013-11-13 | — | — | CN | disclosed |
| WO-2013100963-A1 | PRODUCTION OF TITANIUM DIOXIDE PIGMENTS | FANG ZHIGANG ZAK (US) | 2013-07-04 | — | — | WO | disclosed |
| WO-2013088599-A1 | PLANT GROWTH METHOD AND SILICON-RICH FOLIAGE PLANT | TAKENAKA GARDEN AFFORESTATION INC. (JP) | 2013-06-20 | — | — | WO | disclosed |
| CN-101837990-B | Fluorine-containing all-silica MFI zeolite molecular sieve and preparation method thereof | UNIV JIANGXI NORMAL | 2012-08-22 | — | — | CN | disclosed |
| CN-101837990-A | Fluorine-containing all-silica MFI zeolite molecular sieve and preparation method thereof | UNIV JIANGXI NORMAL | 2010-09-22 | — | — | CN | disclosed |
| CN-101376709-A | Preparation of hydroxy end capped poly(methyl(trifluoropropyl) siloxane) | UNIV HANGZHOU NORMAL (CN) | 2009-03-04 | — | — | CN | disclosed |
| JP-2002020212-A | METHOD FOR ACCELERATING PLANT GROWTH AND AMELIORATING STORAGE, COMPOSITION FOR ACCELERATING PLANT GROWTH AND AMELIORATING STORAGE AND METHOD FOR PRODUCING THE SAME | NEL BIOTECH CO LTD | 2002-01-23 | — | — | JP | disclosed |
| JP-2000245419-A | FUNCTIONAL ALKALINE EARTH IONIZED FOOD ADDITIVE COMPOSITION, ITS PRODUCTION AND USING METHOD | BARODON CASHPIA CORP | 2000-09-12 | — | — | JP | disclosed |