Water

Water

SCHEMBL4336098

O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Tb+3]

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

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.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 known ✓ O00255 1/20 0.67
KMT2A Q03164 1/20 0.67
CA5A P35218 1/20 0.46
CA5B Q9Y2D0 1/20 0.46
TSHR P16473 3/20 0.39
ALDH1A1 P00352 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
HPGD P15428 1/20 0.36
HIF1A Q16665 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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.

Compoundsimilaritytop predictedshared targets
Water SCHEMBL28545898 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL28598369 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL708926 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL1204755 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL2176785 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL2590832 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
SCHEMBL715348 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL10566608 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL28478211 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL28398822 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119858936-A Preparation method of crystal grade terbium trifluoride 西安吉利电子新材料股份有限公司 2025-04-22 CN claimed
CN-119349623-A Preparation method of crystal grade potassium terbium decafluoride 磁县鑫钰光电科技有限公司 2025-01-24 CN claimed
CN-117457753-B Double-active-layer terbium-doped oxide thin film transistor and preparation method thereof 漳州市合琦靶材科技有限公司 2024-11-19 CN claimed
CN-118325117-B Terbium coordination covalent organic framework fluorescent material and preparation method and application thereof 南昌市检验检测中心 2024-08-20 CN claimed
CN-118325117-A Terbium coordination covalent organic framework fluorescent material and preparation method and application thereof 南昌市检验检测中心 2024-07-12 CN claimed
CN-117233407-A Electrochemiluminescence aptamer sensor for detecting 17 beta-estradiol as well as preparation method and application thereof 常州大学 2023-12-15 CN claimed
CN-117012950-A Rare earth element modification method of lithium nickel manganese oxide anode and wide-temperature-zone application 中国科学院金属研究所 2023-11-07 CN claimed
CN-119858936-A Preparation method of crystal grade terbium trifluoride 西安吉利电子新材料股份有限公司 2025-04-22 CN disclosed
WO-2025027146-A1 PHOSPHORS FOR HIGH-POWER APPLICATIONS SEABOROUGH IP I B.V. (NL) 2025-02-06 WO disclosed
EP-4502107-A1 PHOSPHORS FOR HIGH-POWER APPLICATIONS Seaborough IP I B.V. (NL) 2025-02-05 EP disclosed
CN-119349623-A Preparation method of crystal grade potassium terbium decafluoride 磁县鑫钰光电科技有限公司 2025-01-24 CN disclosed
CN-117457753-B Double-active-layer terbium-doped oxide thin film transistor and preparation method thereof 漳州市合琦靶材科技有限公司 2024-11-19 CN disclosed
CN-118325117-B Terbium coordination covalent organic framework fluorescent material and preparation method and application thereof 南昌市检验检测中心 2024-08-20 CN disclosed
US-7498005-B2 Nanoparticles of rare earth oxides PPG INDUSTRIES OHIO, INC. (US) 2009-03-03 US disclosed
US-20080138267-A1 Nanoparticles of rare earth oxides NANOPRODUCTS CORPORATION 2008-06-12 US disclosed
US-7229600-B2 Nanoparticles of rare earth oxides NANOPRODUCTS CORPORATION (US) 2007-06-12 US disclosed
US-20070104629-A1 NANOPARTICLES OF RARE EARTH OXIDES NANOPRODUCTS CORPORATION 2007-05-10 US disclosed
US-20050288538-A1 Catalyst and process for selective hydrogenation LOWE DAVID M 2005-12-29 US disclosed
WO-2005051538-A1 CATALYST AND PROCESS FOR SELECTIVE HYDROGENATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2005-06-09 WO disclosed
US-20050113614-A1 Catalyst and process for selective hydrogenation EXXONMOBIL CHEMICAL PATENTS INC. 2005-05-26 US disclosed