Water

Water

SCHEMBL892502

O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[In+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 SCHEMBL29168442 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL747141 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL744582 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL28339176 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL8021457 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL2590832 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL28398822 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL28478211 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
SCHEMBL50075 0.94 MEN1 (0.75) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL10566608 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 1095 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120081546-B Livestock wastewater treatment process based on biological synergist 南京益德清环保科技有限公司 2026-05-12 CN claimed
CN-122010166-A Two-dimensional ultrathin ZnIn with adjustable indium vacancies2S4Preparation method and application of nanosheet material 广东电驰千里新能源有限公司 2026-05-12 CN claimed
US-12550378-B2 IGZO thin-film transistor and method for manufacturing same SOUTHEAST UNIVERSITY (CN) 2026-02-10 US claimed
EP-4646506-A1 SHAPE-CONTROLLED SYNTHESIS OF III-V COLLOIDAL NANOCRYSTALS Quantum Science Ltd (GB) 2025-11-12 EP claimed
EP-4630187-A1 PRODUCTION OF SILVER NANOPARTICLES BY GREEN SYNTHESIS USING HAZELNUT HUSK EXTRACT Bahçesehir Üniversitesi (TR) 2025-10-15 EP claimed
US-20250215314-A1 PRECURSOR MATERIAL FOR SYNTHESIS OF GROUP III-V QUANTUM DOTS AND PREPARATION METHOD THEREFOR Research & Business Foundation Sungkyunkwan University (KR) 2025-07-03 US claimed
CN-117138802-B Bi (Bi)2MoO6@ZnIn2S4Hierarchical S-shaped heterostructure photocatalyst and preparation method thereof 江西师范大学 2025-06-17 CN claimed
CN-120138712-A Boron nitride-supported cerium-indium metal catalyst, preparation method and application thereof in urea synthesis 嘉兴大学 2025-06-13 CN claimed
CN-120132840-A Cyclohexane dehydrogenation catalyst and preparation method and application thereof 西安凯立新材料股份有限公司 2025-06-13 CN claimed
CN-120117730-A Method for promoting ferrate to remove organic pollutants in water by inducing nano indium oxide through visible light LED lamp 哈尔滨工业大学 2025-06-10 CN claimed
US-20120080678-A1 COMPOSITIONS FOR SOLUTION PROCESS, ELECTRONIC DEVICES FABRICATED USING THE SAME, AND FABRICATION METHODS THEREOF INDUSTRY-ACADEMIC COOPERATION FOUNDATION, YONSEI UNIVERSITY (KR) 2012-04-05 US claimed
CN-102188968-A Core-shell constructed indium-yttrium-antimony-based composite magnetic particle photocatalyst, its preparation and its application NANJING UNIVERSITY OF TECHNOLOGY 2011-09-21 CN claimed
CN-102166513-A Antimony, ytterbium and indium based composite magnetic particle photocatalyst with core-shell structure, preparation and application NANJING UNIVERSITY OF TECHNOLOGY 2011-08-31 CN claimed
CN-102139209-A Core-shell gadolinium indium antimony base composite magnetic-particle photochemical catalyst as well as preparation and application thereof NANJING UNIVERSITY OF TECHNOLOGY 2011-08-03 CN claimed
US-20100258793-A1 Solution composition for forming oxide thin film and electronic device including the oxide thin film INDUSTRY-ACADEMIC COOPERATION FOUNDATION, YONSEI UNIVERSITY (KR) 2010-10-14 US claimed
US-20100251936-A1 METHOD OF FABRICATING LIQUID FOR OXIDE THIN FILM INDUSTRY-ACADEMIC COOPERATION FOUNDATION , (KR) 2010-10-07 US claimed
WO-2009054574-A1 METHOD OF FABRICATING LIQUID FOR OXIDE THIN FILM INDUSTRY-ACADEMIC COOPERATION FOUNDATION, YONSEI UNIVERSITY (KR) 2009-04-30 WO claimed
CN-1034127-C Low glare and anti-static transparent coating composition, method of producing same, and video display coated therewith SAMSUNG ELECTRONIC DEVICES (KR) 1997-02-26 CN claimed
US-5281365-A Obtained by mixing silicate solution containing partially hydrolyzed silicate, conductive solution formed by doping first and second compounds comprising oxides or hydroxides of an inorganic compound, and a metallic compound SAMSUNG ELECTRON DEVICES CO., LTD. (KR) 1994-01-25 US claimed
US-5169565-A ANTI-DAZZLING AND ELECTROSTATIC CHARGE PREVENTIVE TRANSPARENT COATING MATERIAL, METHOD THEREOF AND VIDEO DISPLAY COATED THEREWITH SAMSUNG ELECTRONICS (KR) 1992-12-08 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12550378-B2 IGZO thin-film transistor and method for manufacturing same PTPRO, PTPRZ1, IKZF3 MEN1 4562/4885KMT2A 2869/4885CA5A 3100/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.