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 SCHEMBL2289874 | 1.00 | — | — | |
| Water SCHEMBL270067 | 1.00 | — | — | |
| Water SCHEMBL28208506 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL4823672 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL248474 | 0.82 | — | — | |
| Water SCHEMBL23461833 | 0.67 | — | — | |
| Water SCHEMBL23631871 | 0.67 | — | — | |
| Water SCHEMBL20562889 | 0.67 | — | — | |
| Water SCHEMBL25334174 | 0.67 | — | — | |
| Water SCHEMBL21379772 | 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 82 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240277874-A1 | FLUORESCENCE-MAGNETIC RESONANCE DUAL-MODALITY CONTRAST AGENT, PREPARATION METHOD THEREFOR AND USE THEREOF | HAINAN POLY PHARMACEUTICAL CO., LTD. (CN) | 2024-08-22 | — | — | US | claimed |
| EP-4342499-A1 | FLUORESCENCE-MAGNETIC RESONANCE BIMODAL CONTRAST AGENT, PREPARATION METHOD THEREFOR AND USE THEREOF | Hainan Poly Pharmaceutical Co, .Ltd. (CN) | 2024-03-27 | — | — | EP | claimed |
| CN-115467091-B | Bismuth oxide/gadolinium oxide nanofiber membrane alternately-stacked composite material and preparation method thereof | 东华大学 | 2023-07-04 | — | — | CN | claimed |
| WO-2022242437-A1 | FLUORESCENCE-MAGNETIC RESONANCE BIMODAL CONTRAST AGENT, PREPARATION METHOD THEREFOR AND USE THEREOF | 海南普利制药股份有限公司 | 2022-11-24 | — | — | WO | claimed |
| CN-115364245-A | Fluorescence-magnetic resonance bimodal contrast agent and preparation method and application thereof | 海南普利制药股份有限公司 | 2022-11-22 | — | — | CN | claimed |
| CN-112320833-B | High temperature resistant SiO 2 -Gd 2 O 3 Composite aerogel and preparation method thereof | 湖南荣岚智能科技有限公司 | 2022-08-02 | — | — | CN | claimed |
| US-10307735-B2 | Gd-containing, anti-coking solid acid catalysts and preparation method and use thereof | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) | 2019-06-04 | — | — | US | claimed |
| CN-109385271-A | A kind of fluorescent material and preparation method thereof based on amino acid eutectic solvent | 河北科技大学 | 2019-02-26 | — | — | CN | claimed |
| CN-107998390-A | A kind of photo-thermal diagnosis Integral rice grain of difunctional imaging guiding and preparation method thereof | 湖北大学 | 2018-05-08 | — | — | CN | claimed |
| US-20180065110-A1 | GD-CONTAINING, ANTI-COKING SOLID ACID CATALYSTS AND PREPARATION METHOD AND USE THEREOF | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) | 2018-03-08 | — | — | US | claimed |
| US-9796923-B2 | Color tunable multifunctional nanophosphor, synthesis method thereof, and polymer composite including the nanophosphor | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2017-10-24 | — | — | US | claimed |
| CN-104599725-B | A kind of soluble gadolinium base neutron poison medicament and preparation method thereof | 中国核电工程有限公司 | 2017-07-28 | — | — | CN | claimed |
| CN-104599725-A | Soluble gadolinium-based neutron poison potion and preparation method thereof | CHINA NUCLEAR POWER ENG CO LTD | 2015-05-06 | — | — | CN | claimed |
| US-20140308213-A1 | COLOR TUNABLE MULTIFUNCTIONAL NANOPHOSPHOR, SYNTHESIS METHOD THEREOF, AND POLYMER COMPOSITE INCLUDING THE NANOPHOSPHOR | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2014-10-16 | — | — | US | claimed |
| US-12577463-B2 | Multi-color tunable upconversion nanophosphor | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2026-03-17 | — | — | US | disclosed |
| EP-4206300-B1 | VERSATILE COLOR-TUNABLE UPCONVERSION NANOPHOSPHOR | KOREA INST SCI & TECH (KR) | 2026-03-11 | — | — | EP | disclosed |
| CN-119553126-A | Hard alloy for deep drilling of complex rock stratum and preparation method thereof | 成都岷江精密刀具有限公司 | 2025-03-04 | — | — | CN | disclosed |
| WO-2004031221-A9 | TUMOR TARGETING AGENTS AND USES THEREOF | KARYON OY (FI) | 2004-07-08 | — | — | WO | disclosed |
| WO-2004031218-A1 | TUMOR TARGETING AGENTS AND USES THEREOF | KARYON OY (FI) | 2004-04-15 | — | — | WO | disclosed |
| WO-2004031221-A1 | TUMOR TARGETING AGENTS AND USES THEREOF | KARYON OY (FI) | 2004-04-15 | — | — | WO | disclosed |