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 | |
|---|---|---|---|---|
| SCHEMBL118899 | 0.96 | — | — | |
| SCHEMBL6739890 | 0.96 | — | — | |
| Benzene SCHEMBL5152353 | 0.86 | HTT (0.38) | — | |
| Methylene Chloride SCHEMBL1604482 | 0.83 | HTT (0.30) | — | |
| SCHEMBL908858 | 0.81 | CTSA (0.33) | — | |
| Dimethylformamide SCHEMBL4046504 | 0.81 | TSHR (0.53) | — | |
| SCHEMBL8091799 | 0.78 | CA2 (0.34) | — | |
| Diethylamine SCHEMBL17396366 | 0.76 | TP53 (0.42) | — | |
| SCHEMBL31628393 | 0.75 | — | — | |
| Isobutyramide SCHEMBL9651004 | 0.73 | — | — |
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 111 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116145433-A | Method for synthesizing polyurethane resin by wet method and device for synthesizing polyurethane resin | 台州禾欣高分子新材料有限公司 | 2023-05-23 | — | — | CN | claimed |
| US-20260139075-A1 | NOVEL BIOTIN-SPECIFIC MONOCLONAL ANTIBODY AND USE THEREOF | ROCHE DIAGNOSTICS OPERATIONS INC (US) | 2026-05-21 | — | — | US | disclosed |
| CN-122037917-A | Eu (Eu)3+Complex AIE sensor and preparation and fluorescence cycle recognition Cu thereof2+And the use of ATP | 陇东学院 | 2026-05-15 | — | — | CN | disclosed |
| US-12590115-B2 | Technologies useful for oligonucleotide preparation | WAVE LIFE SCIENCES LTD. (SG) | 2026-03-31 | — | — | US | disclosed |
| EP-3562841-B1 | NOVEL BIOTIN-SPECIFIC MONOCLONAL ANTIBODY AND USE THEREOF | HOFFMANN LA ROCHE (CH) | 2026-03-25 | — | — | EP | disclosed |
| US-20260077056-A1 | LINKER-PAYLOAD COMPOUND, CONJUGATES AND APPLICATIONS THEREOF | GENEQUANTUM HEALTHCARE SUZHOU CO LTD (CN) | 2026-03-19 | — | — | US | disclosed |
| US-12578335-B2 | Bioprobes for lysyl oxidases and uses thereof | SYNTARA LIMITED (AU) | 2026-03-17 | — | — | US | disclosed |
| US-12570665-B2 | Compositions comprising fullerenyl mesochlorin nano-photosensitizers with covalently bound antibiotics and their uses in combination therapy | UNIVERSITY OF MASSACHUSETTS (US) | 2026-03-10 | — | — | US | disclosed |
| US-20260055133-A1 | COMPOUNDS, COMPOSITIONS AND METHODS FOR SYNTHESIS | WAVE LIFE SCIENCES LTD (SG) | 2026-02-26 | — | — | US | disclosed |
| US-12559573-B2 | Biotin-specific monoclonal antibody and use thereof | ROCHE DIAGNOSTICS OPERATIONS, INC. (US) | 2026-02-24 | — | — | US | disclosed |
| CN-111393445-B | Phenazine derivative-based supramolecular sensor and preparation and application thereof | 西北师范大学 | 2022-04-15 | — | — | CN | disclosed |
| CN-111393445-B | Phenazine derivative-based supramolecular sensor and preparation and application thereof | 西北师范大学 | 2022-04-15 | — | — | CN | disclosed |
| US-20220112227-A1 | CYCLIC SUPPORTED CATALYSTS | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2022-04-14 | — | — | US | disclosed |
| US-20220106408-A1 | NOVEL BIOTIN-SPECIFIC MONOCLONAL ANTIBODY AND USE THEREOF | ROCHE DIAGNOSTICS GMBH (DE) | 2022-04-07 | — | — | US | disclosed |
| US-20220107310-A1 | NOVEL BIOTIN-SPECIFIC MONOCLONAL ANTIBODY AND USE THEREOF | ROCHE DIAGNOSTICS OPERATIONS, INC. | 2022-04-07 | — | — | US | disclosed |
| US-20220107309-A1 | NOVEL BIOTIN-SPECIFIC MONOCLONAL ANTIBODY AND USE THEREOF | ROCHE DIAGNOSTICS GMBH (DE) | 2022-04-07 | — | — | US | disclosed |
| CN-109971465-B | Multifunctional fluorescent probe with ESIPT (electron fluorescence tomography) and AIE (electron emission tomography) properties and preparation method and application thereof | 渤海大学 | 2022-03-18 | — | — | CN | disclosed |
| WO-2022043238-A1 | PENTAVALENT VACCINE AGAINST NEISSERIA MENINGITIDIS COMPRISING A SYNTHETIC MEN A ANTIGEN | GLAXOSMITHKLINE BIOLOGICALS SA (BE) | 2022-03-03 | — | — | WO | disclosed |
| CN-110967325-B | Column [5] arene supramolecular compound modified by mercaptoester and synthesis and application thereof | 西北师范大学 | 2022-02-11 | — | — | CN | disclosed |
| CN-110967325-B | Column [5] arene supramolecular compound modified by mercaptoester and synthesis and application thereof | 西北师范大学 | 2022-02-11 | — | — | CN | disclosed |