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 SCHEMBL27944804 | 1.00 | — | — | |
| Water SCHEMBL3715699 | 1.00 | — | — | |
| Water SCHEMBL28160023 | 1.00 | — | — | |
| Water SCHEMBL6720364 | 1.00 | — | — | |
| Water SCHEMBL142401 | 1.00 | — | — | |
| Water SCHEMBL9472198 | 1.00 | — | — | |
| Water SCHEMBL59643 | 1.00 | — | — | |
| Water SCHEMBL3715698 | 1.00 | — | — | |
| Water SCHEMBL3900369 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL23670972 | 0.87 | — | — |
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 501 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119081626-A | Flame-retardant polyurethane composite material and preparation method thereof | 丽水学院 | 2024-12-06 | — | — | CN | claimed |
| CN-118421166-A | Acid and alkali resistant insulating powder and preparation method thereof | 宁波博士盾纳米新材料科技有限公司 | 2024-08-02 | — | — | CN | claimed |
| CN-116180256-B | Flame-retardant polypropylene staple fiber and preparation method thereof | 湖北博韬合纤有限公司 | 2023-09-19 | — | — | CN | claimed |
| CN-116180256-A | Flame-retardant polypropylene staple fiber and preparation method thereof | 湖北博韬合纤有限公司 | 2023-05-30 | — | — | CN | claimed |
| CN-113403863-A | Waterproof flame-retardant high-strength outdoor bag fabric and preparation method thereof | 中纺新材料科技有限公司 | 2021-09-17 | — | — | CN | claimed |
| CN-110950582-A | Heat-insulating anticorrosive flame-retardant material and preparation method thereof | 江苏科趣新材料科技有限公司 | 2020-04-03 | — | — | CN | claimed |
| CN-109704992-A | A method of reducing toluene di-isocyanate(TDI) acidity | 甘肃银光聚银化工有限公司 | 2019-05-03 | — | — | CN | claimed |
| CN-109420482-A | A kind of magnesia-alumina composite catalyst and preparation method thereof | 张家港市沐和新材料技术开发有限公司 | 2019-03-05 | — | — | CN | claimed |
| CN-107099097-A | A kind of COPP biaxially oriented film material and its industrial process | 中国石油化工股份有限公司 | 2017-08-29 | — | — | CN | claimed |
| CN-105017712-B | Crystallization regulation system and application of crystallization regulation system in rapid molding of polyformaldehyde panel/bar | 青岛科技大学 | 2017-05-10 | — | — | CN | claimed |
| EP-0663300-A1 | Ink jet recording sheet | NEW OJI PAPER CO., LTD. (JP) | 1995-07-19 | — | — | EP | claimed |
| EP-0600725-A1 | Pharmaceutical compositions containing a guanidinothiazole and antacids | McNEIL-PPC, INC. (US) | 1994-06-08 | — | — | EP | claimed |
| CN-1086129-A | Novel treatment | SMITHKLINE BEECHAM PLC (GB) | 1994-05-04 | — | — | CN | claimed |
| US-4937076-A | CHOCOLATE OR HYDROGENATED TALLOW AS COATING AND BINDER; STORAGE STABILITY | COMBE INCORPORATED (US) | 1990-06-26 | — | — | US | claimed |
| EP-0197951-B1 | FILM LAMINATE FOR STERILE FLEXIBLE CONTAINERS | FUJIMORI KOGYO CO., LTD. (JP) | 1990-03-07 | — | — | EP | claimed |
| EP-0275834-A1 | Continuous process for producing a comestible tablet | WARNER-LAMBERT COMPANY (US) | 1988-07-27 | — | — | EP | claimed |
| US-4542019-A | Antacid compositions | LEZDEY JOHN | 1985-09-17 | — | — | US | claimed |
| EP-0147692-A1 | Poly(arylene sulfide) composition and article of manufacture | PHILLIPS PETROLEUM COMPANY (US) | 1985-07-10 | — | — | EP | claimed |
| EP-0003589-B1 | ANTACID TABLET FORMULATION | THE WELLCOME FOUNDATION LIMITED (GB) | 1984-04-11 | — | — | EP | claimed |
| EP-0003589-A2 | Antacid tablet formulation | THE WELLCOME FOUNDATION LIMITED (GB) | 1979-08-22 | — | — | EP | claimed |