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 SCHEMBL27608953 | 1.00 | — | — | |
| Ammonia Solution, Strong SCHEMBL27643163 | 0.87 | — | — | |
| Methane SCHEMBL28279094 | 0.87 | — | — | |
| Water SCHEMBL8466513 | 0.82 | — | — | |
| Water SCHEMBL2355031 | 0.82 | — | — | |
| SCHEMBL771067 | 0.82 | — | — | |
| Water SCHEMBL8055071 | 0.82 | — | — | |
| Water SCHEMBL837641 | 0.82 | — | — | |
| Water SCHEMBL251541 | 0.82 | — | — | |
| Water SCHEMBL7168086 | 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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104353844-B | Preparation method of silica/gold/ silica three-layer nano particles | 西安交通大学 | 2017-01-11 | — | — | CN | claimed |
| CN-105510411-A | Method for single cancer cell detection based on cell-microelectrode interaction | UNIV SHAANXI NORMAL | 2016-04-20 | — | — | CN | claimed |
| CN-116827442-A | Method for realizing chiral nanometer light source, method for exciting chiral light and method for controlling chiral light signal | 北京大学 | 2023-09-29 | — | — | CN | disclosed |
| CN-111511468-B | Heterogeneous catalyst for the production of methyl methacrylate by oxidative esterification | 陶氏环球技术有限责任公司 | 2023-07-11 | — | — | CN | disclosed |
| CN-108258058-B | Preparation method of composite thin film transistor based on gold/silicon dioxide shell-core microstructure and molybdenum disulfide | 福州大学 | 2020-08-11 | — | — | CN | disclosed |
| CN-108258058-B | Preparation method of composite thin film transistor based on gold/silicon dioxide shell-core microstructure and molybdenum disulfide | 福州大学 | 2020-08-11 | — | — | CN | disclosed |
| CN-105419802-B | A kind of preparation method for heating thermometric dual-functionality nano-particle | 西安交通大学 | 2017-06-23 | — | — | CN | disclosed |
| CN-106391005-A | Preparation method of multilayered silicon dioxide particles for catalytic column | 北京化大宏博应用技术研究院有限公司安庆分公司 | 2017-02-15 | — | — | CN | disclosed |
| CN-104353844-B | Preparation method of silica/gold/ silica three-layer nano particles | 西安交通大学 | 2017-01-11 | — | — | CN | disclosed |
| CN-104086720-B | A kind of preparation method of the bivalve layer nuclear shell structure nano compound particle with cavity | QILU UNIVERSITY OF TECHNOLOGY (CN) | 2017-01-04 | — | — | CN | disclosed |
| CN-105510411-A | Method for single cancer cell detection based on cell-microelectrode interaction | UNIV SHAANXI NORMAL | 2016-04-20 | — | — | CN | disclosed |
| US-20020169235-A1 | Temperature-sensitive polymer/nanoshell composites for photothermally modulated drug delivery | WM. MARSH RICE UNIVERSITY (US) | 2002-11-14 | — | — | US | disclosed |
| US-6428811-B1 | IMPLANTABLE OR INJECTABLE MATERIAL; CONTROLLED RELEASE OF MEDICATION, SUCH AS INSULIN VIA LOCALIZED HEATING FROM EXTERNAL EXPOSURE TO NEAR-IR LIGHT; NONDAMAGING TO SURROUNDING BODY TISSUE; DIABETES MELLITUS | WM. MARSH RICE UNIVERSITY | 2002-08-06 | — | — | US | disclosed |
| EP-1208005-A1 | TEMPERATURE-SENSITIVE POLYMER/NANOSHELL COMPOSITES FOR PHOTOTHERMALLY MODULATED DRUG DELIVERY | Wm. MARSH RICE UNIVERSITY (US) | 2002-05-29 | — | — | EP | disclosed |
| WO-2001005586-A1 | TEMPERATURE-SENSITIVE POLYMER/NANOSHELL COMPOSITES FOR PHOTOTHERMALLY MODULATED DRUG DELIVERY | WM. MARSH RICE UNIVERSITY (US) | 2001-01-25 | — | — | WO | disclosed |
| EP-0491502-A2 | Vertical-cavity surface-emitting laser with non-epitaxial multilayered dielectric reflectors located on both surfaces | AT&T Corp. (US) | 1992-06-24 | — | — | EP | disclosed |
| US-5063569-A | Vertical-cavity surface-emitting laser with non-epitaxial multilayered dielectric reflectors located on both surfaces | AT&T BELL LABORATORIES (US) | 1991-11-05 | — | — | US | disclosed |
| US-4716071-A | Method of ensuring adhesion of chemically vapor deposited oxide to gold integrated circuit interconnect lines | HARRIS CORPORATION (US) | 1987-12-29 | — | — | US | disclosed |
| US-4713260-A | Method of ensuring adhesion of chemically vapor deposited oxide to gold integrated circuit interconnect lines | HARRIS CORPORATION | 1987-12-15 | — | — | US | disclosed |
| US-4624749-A | Electrodeposition of submicrometer metallic interconnect for integrated circuits | HARRIS CORPORATION (US) | 1986-11-25 | — | — | US | disclosed |