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 SCHEMBL26966454 | 1.00 | — | — | |
| SCHEMBL56295 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL2731248 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL28936399 | 0.73 | — | — | |
| Ethane SCHEMBL1862515 | 0.71 | — | — | |
| SCHEMBL30300625 | 0.69 | — | — | |
| SCHEMBL2554291 | 0.62 | — | — | |
| SCHEMBL30773896 | 0.61 | — | — | |
| SCHEMBL30378180 | 0.58 | — | — | |
| SCHEMBL7789947 | 0.58 | — | — |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102543247-A | Composite conductive powder | SHANGHAI SILICATE RES INST CERAMIC RES DEV CT FOSHAN CHINESE ACADEMY OF SCIENCES | 2012-07-04 | — | — | CN | claimed |
| CN-111971233-B | Liquid container lid and apparatus and method of use | 施特里克斯美国股份有限公司 | 2022-12-13 | — | — | CN | disclosed |
| CN-109650449-B | Preparation method of molybdenum oxide nano material, product and application | 浙江大学 | 2019-12-31 | — | — | CN | disclosed |
| CN-109734111-A | A kind of alumina-producing method and equipment | 国家电投集团山西铝业有限公司 | 2019-05-10 | — | — | CN | disclosed |
| CN-109701635-A | A kind of iron-based molecular sieve catalyst and the preparation method and application thereof for nitrous oxide | 中国人民大学 | 2019-05-03 | — | — | CN | disclosed |
| CN-108026401-A | Iron oxide dispersion for ink-jet recording, method for producing same, and ink-jet recording method | 富士胶片株式会社 | 2018-05-11 | — | — | CN | disclosed |
| CN-102543247-B | A kind of composite conductive powder | SHANGHAI SILICATE Research Institute CERAMIC RESEARCH DEVELOPMENT CENTER FOSHAN CHINESE ACADEMY OF SCIENCES (CN) | 2015-12-09 | — | — | CN | disclosed |
| CN-102543247-A | Composite conductive powder | SHANGHAI SILICATE RES INST CERAMIC RES DEV CT FOSHAN CHINESE ACADEMY OF SCIENCES | 2012-07-04 | — | — | CN | disclosed |
| EP-1788040-B1 | INSULATED ULTRAFINE POWDER AND HIGH DIELECTRIC CONSTANT RESIN COMPOSITE MATERIAL | MITSUBISHI GAS CHEMICAL CO (JP) | 2012-06-06 | — | — | EP | disclosed |
| US-8184035-B2 | Insulated ultrafine powder and high dielectric constant resin composite material | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2012-05-22 | — | — | US | disclosed |
| US-20110102231-A1 | INSULATED ULTRAFINE POWDER AND HIGH DIELECTRIC CONSTANT RESIN COMPOSITE MATERIAL | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2011-05-05 | — | — | US | disclosed |
| EP-1788040-A1 | INSULATED ULTRAFINE POWDER AND HIGH DIELECTRIC CONSTANT RESIN COMPOSITE MATERIAL | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2007-05-23 | — | — | EP | disclosed |
| EP-0320023-B1 | Macroporous polymeric membranes, their preparation and their use for polymer separation | CESKOSLOVENSKA AKADEMIE VED (CS) | 1994-09-21 | — | — | EP | disclosed |
| EP-0320023-A2 | Macroporous polymeric membranes, their preparation and their use for polymer separation | Ceskoslovenska akademie ved (CS) | 1989-06-14 | — | — | EP | disclosed |
| US-4487943-A | Catalytic process for the preparation of tetrahydropyran by homologation of tetrahydrofuran | EASTMAN KODAK COMPANY (US) | 1984-12-11 | — | — | US | disclosed |