Water

Water

SCHEMBL8991493

N#C[Fe](C#N)(C#N)(C#N)(C#N)C#N.O.[KH]

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 SCHEMBL18229968 1.00 — —
SCHEMBL18045212 1.00 — —
SCHEMBL10979445 1.00 — —
SCHEMBL11674568 1.00 — —
Water SCHEMBL717160 1.00 — —
Water SCHEMBL717161 1.00 — —
SCHEMBL7636286 1.00 — —
SCHEMBL379098 1.00 — —
Water SCHEMBL1014182 1.00 — —
Water SCHEMBL8965395 1.00 — —

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103093974-B The preparation method of Graphene/cobalt hydroxide-potassium ferricyanide/potassium hydroxide ultracapacitor energy storage electrode system JILIN UNIVERSITY (CN) 2016-03-30 — — CN claimed
CN-103093974-A Prepared method of super capacitor energy storing electrode system of graphene, cobalt hydroxide-potassium ferricyanide and potassium hydroxide UNIV JILIN 2013-05-08 — — CN claimed
CN-103093974-B The preparation method of Graphene/cobalt hydroxide-potassium ferricyanide/potassium hydroxide ultracapacitor energy storage electrode system JILIN UNIVERSITY (CN) 2016-03-30 — — CN disclosed
CN-104269281-A Method for manufacturing asymmetric super capacitor UNIV JILIN 2015-01-07 — — CN disclosed
CN-103093974-A Prepared method of super capacitor energy storing electrode system of graphene, cobalt hydroxide-potassium ferricyanide and potassium hydroxide UNIV JILIN 2013-05-08 — — CN disclosed
EP-0482207-B1 LAMINATED ORGANIC NONLINEAR OPTICAL CRYSTAL AND PRODUCTION THEREOF TORAY INDUSTRIES (JP) 1996-07-24 — — EP disclosed
US-5388328-A Forming metal layer, forming resist, filling windows in resist with conductor by plating, forming another windowed resist, filling windows with conductor, dissolving resist, filling spacings with varnish, curing HITACHI, LTD. (JP) 1995-02-14 — — US disclosed
US-5300735-A Interconnected multilayer boards and fabrication processes thereof HITACHI, LTD. (JP) 1994-04-05 — — US disclosed
US-5284548-A Process for producing electrical circuits with precision surface features MICROELECTRONICS AND COMPUTER TECHNOLOGY CORPORATION (US) 1994-02-08 — — US disclosed
EP-0482207-A1 LAMINATED ORGANIC NONLINEAR OPTICAL CRYSTAL AND PRODUCTION THEREOF TORAY INDUSTRIES, INC. (JP) 1992-04-29 — — EP disclosed
US-4963512-A Method for forming conductor layers and method for fabricating multilayer substrates HITACHI, LTD. (JP) 1990-10-16 — — US disclosed
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