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 | |
|---|---|---|---|---|
| SCHEMBL39995 | 0.95 | — | — | |
| SCHEMBL28205893 | 0.90 | — | — | |
| Fluoride SCHEMBL27524549 | 0.90 | — | — | |
| Methane SCHEMBL29042620 | 0.90 | — | — | |
| SCHEMBL3909902 | 0.90 | — | — | |
| SCHEMBL30672226 | 0.90 | — | — | |
| Ethane SCHEMBL29042623 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL27635995 | 0.90 | — | — | |
| Ethylene SCHEMBL27532163 | 0.86 | — | — | |
| Fluoromethane SCHEMBL27728763 | 0.86 | — | — |
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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107012456-B | Modified metal surface pretreating reagent of a kind of alkoxyl silicone ethyl Polyhedral Oligomeric silsesquioxane and preparation method thereof, application | 武汉大学 | 2019-06-28 | — | — | CN | disclosed |
| CN-109810669-A | A kind of poly- silicone resin and its preparation method and application | 广州市高士实业有限公司 | 2019-05-28 | — | — | CN | disclosed |
| CN-103869613-A | Colored hardening composite, pattern hardeninig colored layer using same, colored filter and liquid crystal display device | SUMITOMO CHEMICAL CO | 2014-06-18 | — | — | CN | disclosed |
| CN-101598897-B | Colored curable composition, pattern-cured colored layer using same, color filter, and liquid crystal display device | SUMITOMO CHEMICAL CO | 2014-05-14 | — | — | CN | disclosed |
| CN-101376977-B | Electrogalvanized and chromate-free chemical conversion treated steel plate with excellent white rust resistant performance | KOBE STEEL LTD | 2011-01-19 | — | — | CN | disclosed |
| CN-101598897-A | colored curable composition | SUMITOMO CHEMICAL CO (JP) | 2009-12-09 | — | — | CN | disclosed |
| CN-101544081-A | Resin-coated metal plate with excellent film peelability in the roll forming process | KOBE STEEL LTD | 2009-09-30 | — | — | CN | disclosed |
| CN-100501945-C | Organic thin film transistor element and method for manufacturing the same | KONICA MINOLTA HOLDINGS INC (JP) | 2009-06-17 | — | — | CN | disclosed |
| CN-101395215-A | Aqueous resin composition | TOHO CHEM IND CO LTD (JP) | 2009-03-25 | — | — | CN | disclosed |
| CN-101376977-A | Electrogalvanized and chromate-free chemical conversion treated steel plate with excellent white rust resistant performance | KOBE STEEL LTD (JP) | 2009-03-04 | — | — | CN | disclosed |
| CN-1952779-A | Colored photosensitive resin composition | SUMITOMO CHEMICAL CO (JP) | 2007-04-25 | — | — | CN | disclosed |
| CN-1280326-C | Rapid-cure, one-component mixtures, which contain alkoxysilane-terminated polymers | CONSORTIUM ELEKTROCHEM IND (DE) | 2006-10-18 | — | — | CN | disclosed |
| CN-1276273-C | Optical element with anti-resist-film | HOYA CORP (JP) | 2006-09-20 | — | — | CN | disclosed |
| CN-1751385-A | Organic thin film transistor element and method for manufacturing the same | KONICA MINOLTA HOLDINGS INC (JP) | 2006-03-22 | — | — | CN | disclosed |
| CN-1703761-A | Fluorine-containing polymer solid electrolyte containing fluorine-containing ether chain | DAIKIN IND LTD (JP) | 2005-11-30 | — | — | CN | disclosed |
| CN-1639219-A | One-component mixture containing a rapidly curing alkoxysilane-terminated polymer | CONSORTIUM ELEKTROCHEM IND (DE) | 2005-07-13 | — | — | CN | disclosed |
| CN-1196945-C | Method for preparing coating composition for spectacles lens | HOYA CORP (JP) | 2005-04-13 | — | — | CN | disclosed |
| CN-1543678-A | Functional device and production method therefor | ���ṫ˾ | 2004-11-03 | — | — | CN | disclosed |
| CN-1414398-A | Optical element with anti-resist-film | HOYA CORP (JP) | 2003-04-30 | — | — | CN | disclosed |
| CN-1346987-A | Method for preparing coating composition for spectacles lens | HOYA CORP (JP) | 2002-05-01 | — | — | CN | disclosed |