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 SCHEMBL3319692 | 1.00 | — | — | |
| Ammonia Solution, Strong SCHEMBL27968116 | 0.87 | — | — | |
| Water SCHEMBL29193757 | 0.87 | — | — | |
| Water SCHEMBL27712351 | 0.87 | — | — | |
| Methane SCHEMBL28886332 | 0.87 | — | — | |
| Water SCHEMBL28002101 | 0.87 | — | — | |
| Water SCHEMBL28544604 | 0.87 | — | — | |
| Fluoride SCHEMBL21528063 | 0.87 | — | — | |
| Water SCHEMBL20897135 | 0.87 | — | — | |
| Water SCHEMBL28033227 | 0.87 | — | — |
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-120197556-A | Method, device, equipment and medium for selecting desert ecological management scheme | 浙江大学 | 2025-06-24 | — | — | CN | disclosed |
| CN-119787435-A | Low-electric-cost charging station system | 爱卜乐(东莞市)互联网有限公司 | 2025-04-08 | — | — | CN | disclosed |
| CN-119461927-A | Preparation method of modified waste concrete recycled aggregate and artificial stone prepared by same | 中建海龙科技有限公司 | 2025-02-18 | — | — | CN | disclosed |
| EP-4118056-A1 | PROCESSES FOR PRODUCING FOAMED CONCRETE | Wacker Chemie AG (DE) | 2023-01-18 | — | — | EP | disclosed |
| CN-115259766-A | Alkali-activated fly ash concrete and preparation method thereof | 贾君 | 2022-11-01 | — | — | CN | disclosed |
| CN-103601425-A | Additive for concrete with strength grade more than 20C | ZHOU ZHAODI | 2014-02-26 | — | — | CN | disclosed |
| US-8431646-B2 | Mixture containing organosilicon compound and use thereof | EVONIK DEGUSSA GMBH (DE) | 2013-04-30 | — | — | US | disclosed |
| CN-101428153-B | Hydrogen phosphate/tricalcium silicate composite self-curing material with biological activity, preparation and uses thereof | SHANGHAI INST CERAMICS | 2013-03-13 | — | — | CN | disclosed |
| CN-101157045-B | Complex self-curing material, method and application of bioactivity calcium phosphate/tricalcium silicate | SHANGHAI INST CERAMICS | 2010-05-19 | — | — | CN | disclosed |
| US-20100119851-A1 | MIXTURE CONTAINING ORGANOSILICON COMPOUND AND USE THEREOF | EVONIK DEGUSSA GMBH (DE) | 2010-05-13 | — | — | US | disclosed |
| CN-100496625-C | Calcium sulfate semihydrate group combined self-curing bio-active material, preparation and application thereof | SHANGHAI INST CERAMICS (CN) | 2009-06-10 | — | — | CN | disclosed |
| CN-101428153-A | Hydrogen phosphate/tricalcium silicate composite self-curing material with biological activity, preparation and uses thereof | SHANGHAI INST CERAMICS (CN) | 2009-05-13 | — | — | CN | disclosed |
| CN-101157045-A | Complex self-curing material, method and application of bioactivity calcium phosphate/tricalcium silicate | SHANGHAI INST CERAMICS (CN) | 2008-04-09 | — | — | CN | disclosed |
| CN-1923302-A | Calcium sulfate semihydrate group combined self-curing bio-active material, preparation and application thereof | SHANGHAI INST CERAMICS (CN) | 2007-03-07 | — | — | CN | disclosed |
| CN-1370756-A | ultra-high strength cement concrete | GU FANFENG (CN) | 2002-09-25 | — | — | CN | disclosed |