Water

Water

SCHEMBL1237503

O.O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Ru+3]

nearest known ligand 0.00

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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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 SCHEMBL1316344 1.00
Water SCHEMBL1251114 1.00
Water SCHEMBL115380 1.00
Water SCHEMBL4653984 1.00
Water SCHEMBL187338 1.00
Hydrochloric Acid SCHEMBL52396 0.82
Water SCHEMBL28232325 0.82
Water SCHEMBL9700718 0.82
Water SCHEMBL27538871 0.82
Water SCHEMBL25188536 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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9592484-B2 Gasification of carbonaceous materials and gas to liquid processes HRD CORPORATION (US) 2017-03-14 US claimed
US-9192896-B2 System and process for production of liquid product from light gas H R D CORPORATION (US) 2015-11-24 US claimed
US-20130142706-A1 GASIFICATION OF CARBONACEOUS MATERIALS AND GAS TO LIQUID PROCESSES H R D CORPORATION (US) 2013-06-06 US claimed
US-8026403-B2 System and process for production of liquid product from light gas H R D CORPORATION 2011-09-27 US claimed
US-20100329944-A1 SYSTEM AND PROCESS FOR PRODUCTION OF LIQUID PRODUCT FROM LIGHT GAS H R D CORPORATION (US) 2010-12-30 US claimed
US-20090001316-A1 SYSTEM AND PROCESS FOR PRODUCTION OF LIQUID PRODUCT FROM LIGHT GAS H R D CORPORATION (US) 2009-01-01 US claimed
US-20170129833-A1 GASIFICATION OF CARBONACEOUS MATERIALS AND GAS TO LIQUID PROCESSES H R D CORPORATION 2017-05-11 US disclosed
US-9592484-B2 Gasification of carbonaceous materials and gas to liquid processes HRD CORPORATION (US) 2017-03-14 US disclosed
US-9192896-B2 System and process for production of liquid product from light gas H R D CORPORATION (US) 2015-11-24 US disclosed
US-8497309-B2 Gasification of carbonaceous materials and gas to liquid processes H R D CORPORATION (US) 2013-07-30 US disclosed
US-20130142706-A1 GASIFICATION OF CARBONACEOUS MATERIALS AND GAS TO LIQUID PROCESSES H R D CORPORATION (US) 2013-06-06 US disclosed
US-8394861-B2 Gasification of carbonaceous materials and gas to liquid processes HRD CORPORATION (US) 2013-03-12 US disclosed
US-20120252908-A1 GASIFICATION OF CARBONACEOUS MATERIALS AND GAS TO LIQUID PROCESSES H R D CORPORATION (US) 2012-10-04 US disclosed
US-8026403-B2 System and process for production of liquid product from light gas H R D CORPORATION 2011-09-27 US disclosed
WO-2011017158-A2 GASIFICATION OF CARBONACEOUS MATERIALS AND GAS TO LIQUID PROCESSES HRD CORPORATION (US) 2011-02-10 WO disclosed
US-20100329944-A1 SYSTEM AND PROCESS FOR PRODUCTION OF LIQUID PRODUCT FROM LIGHT GAS H R D CORPORATION (US) 2010-12-30 US disclosed
US-20100317748-A1 GASIFICATION OF CARBONACEOUS MATERIALS AND GAS TO LIQUID PROCESSES HRD CORP. (US) 2010-12-16 US disclosed
EP-2152406-A1 SYSTEM AND PROCESS FOR PRODUCTION OF LIQUID PRODUCT FROM LIGHT GAS H R D Corporation (US) 2010-02-17 EP disclosed
US-20090001316-A1 SYSTEM AND PROCESS FOR PRODUCTION OF LIQUID PRODUCT FROM LIGHT GAS H R D CORPORATION (US) 2009-01-01 US disclosed
WO-2009003031-A1 SYSTEM AND PROCESS FOR PRODUCTION OF LIQUID PRODUCT FROM LIGHT GAS H R D CORPORATION (US) 2008-12-31 WO disclosed