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 SCHEMBL27950115 | 1.00 | — | — | |
| Ammonia Solution, Strong SCHEMBL27615198 | 0.87 | — | — | |
| Water SCHEMBL23501481 | 0.82 | — | — | |
| Water SCHEMBL19026 | 0.82 | — | — | |
| Water SCHEMBL4449068 | 0.67 | — | — | |
| Water SCHEMBL21724127 | 0.67 | — | — | |
| Water SCHEMBL21225084 | 0.67 | — | — | |
| Water SCHEMBL20703393 | 0.67 | — | — | |
| Water SCHEMBL20819967 | 0.67 | — | — | |
| Water SCHEMBL4426502 | 0.67 | — | — |
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 1269 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-121698378-B | CsCu3S2Semiconductor material CsCu3S2/Ga2O3Heterojunction and application thereof in photoelectric detection | 安徽大学 | 2026-05-15 | — | — | CN | claimed |
| CN-119977829-A | Quick synthesis method of beta-amino acid derivative | 华南理工大学 | 2025-05-13 | — | — | CN | claimed |
| CN-119954393-A | P-based2O5Method for controlling geopolymer curing nuclear waste | 中建材玻璃新材料研究院集团有限公司 | 2025-05-09 | — | — | CN | claimed |
| CN-119219626-A | Preparation method of amide-containing indolo [2,1-a ] isoquinoline compound | 内蒙古大学 | 2024-12-31 | — | — | CN | claimed |
| CN-117820775-B | Organic ferroelectric liquid crystal film material and preparation method and application thereof | 武汉中科先进材料科技有限公司 | 2024-12-06 | — | — | CN | claimed |
| CN-119038602-A | Cesium-doped bismuth vanadate material and preparation method and application thereof | 陕西师范大学 | 2024-11-29 | — | — | CN | claimed |
| CN-118772610-A | PBAT/TPS-RC full-biodegradable material with double shape memory performance prepared by closed-loop recovered caprolactone | 华南理工大学 | 2024-10-15 | — | — | CN | claimed |
| CN-118684621-A | Diphenylamine bridged pyridine compound, ruthenium complex, preparation method thereof and application thereof in methylation reaction | 河北师范大学 | 2024-09-24 | — | — | CN | claimed |
| CN-118666879-A | Method for synthesizing chiral aryl/alkyl substituted cyclopropyl borate | 华东师范大学 | 2024-09-20 | — | — | CN | claimed |
| CN-116283772-B | Compound with cyclobutene structure and preparation method and application thereof | 华南理工大学 | 2024-09-03 | — | — | CN | claimed |
| US-5545712-A | Preparation process for polyoxyalkylene polyol | MITSU TOATSU CHEMICALS, INC. (JP) | 1996-08-13 | — | — | US | claimed |
| EP-0587364-B1 | A process for anomerizing nucleosides | LILLY CO ELI (US) | 1996-06-05 | — | — | EP | claimed |
| EP-0463555-B1 | Preparation of aluminoxanes | ALBEMARLE CORP (US) | 1996-02-28 | — | — | EP | claimed |
| WO-1996001296-A1 | WORKING FLUIDS FOR ABSORPTION MACHINES | KELLER JUERGEN (DE) | 1996-01-18 | — | — | WO | claimed |
| US-5468840-A | Preparation process of polyoxyalkylene polyols and process of alkylene oxide recovery | MITSUI TOATSU CHEMICALS, INC. (JP) | 1995-11-21 | — | — | US | claimed |
| US-5420266-A | Basic isomerization of nucleosides with hydroxides | ELI LILLY AND COMPANY (US) | 1995-05-30 | — | — | US | claimed |
| EP-0641814-A1 | Process for the regeneration of a catalyst from polyalkylene polyols | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1995-03-08 | — | — | EP | claimed |
| EP-0587364-A1 | A process for anomerizing nucleosides | ELI LILLY AND COMPANY (US) | 1994-03-16 | — | — | EP | claimed |
| EP-0463555-A2 | Preparation of aluminoxanes | ALBEMARLE CORPORATION (US) | 1992-01-02 | — | — | EP | claimed |
| US-5041583-A | Preparation of aluminoxanes | ETHYL CORPORATION (US) | 1991-08-20 | — | — | US | claimed |