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 SCHEMBL27484422 | 0.97 | FFAR3 (0.40) | — | |
| SCHEMBL48574 | 0.97 | — | — | |
| SCHEMBL295324 | 0.94 | — | — | |
| SCHEMBL11641998 | 0.94 | — | — | |
| SCHEMBL1278333 | 0.94 | — | — | |
| SCHEMBL2769951 | 0.94 | — | — | |
| SCHEMBL2771734 | 0.94 | — | — | |
| SCHEMBL2769593 | 0.94 | — | — | |
| SCHEMBL8557665 | 0.94 | — | — | |
| SCHEMBL2770312 | 0.94 | — | — |
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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021045556-A1 | BIOMEDICAL IMPLANT COMPRISING SURFACE-MODIFIED INORGANIC NANOPARTICLE AND BIODEGRADABLE POLYMER, AND PREPARATION METHOD THEREFOR | 차의과학대학교 산학협력단 | 2021-03-11 | — | — | WO | claimed |
| WO-2020017816-A1 | BIO-IMPLANT COMPRISING SURFACE-MODIFIED ALKALINE CERAMIC PARTICLES AND BIODEGRADABLE POLYMER AND PREPARATION METHOD THEREFOR | 차의과학대학교 산학협력단 | 2020-01-23 | — | — | WO | claimed |
| WO-2022191580-A1 | BIODEGRADABLE POLYMER SUPPORT CONTAINING BIOACTIVE MATERIAL AND MANUFACTURING METHOD THEREFOR | 차의과학대학교 산학협력단 | 2022-09-15 | — | — | WO | disclosed |
| WO-2021045556-A1 | BIOMEDICAL IMPLANT COMPRISING SURFACE-MODIFIED INORGANIC NANOPARTICLE AND BIODEGRADABLE POLYMER, AND PREPARATION METHOD THEREFOR | 차의과학대학교 산학협력단 | 2021-03-11 | — | — | WO | disclosed |
| WO-2020017816-A1 | BIO-IMPLANT COMPRISING SURFACE-MODIFIED ALKALINE CERAMIC PARTICLES AND BIODEGRADABLE POLYMER AND PREPARATION METHOD THEREFOR | 차의과학대학교 산학협력단 | 2020-01-23 | — | — | WO | disclosed |
| CN-104894034-B | A kind of marine source micromonospora SCSIO 01819, enzymes soln and its preparation method and application | 中国科学院南海海洋研究所 | 2018-01-19 | — | — | CN | disclosed |
| EP-3057435-A1 | STRUCTURED TRIACYLGLYCEROLS AND METHODS FOR MAKING THE SAME | The University Of Georgia Research Foundation, Inc (US) | 2016-08-24 | — | — | EP | disclosed |
| US-20160227810-A1 | STRUCTURED TRIACYLGLYCEROLS AND METHODS FOR MAKING THE SAME | KING ABDULAZIZ UNIVERSITY (SA) | 2016-08-11 | — | — | US | disclosed |
| CN-105848485-A | Structural triacylglycerols and methods for making structural triacylglycerols | 乔治亚大学研究基金公司 | 2016-08-10 | — | — | CN | disclosed |
| CN-104894034-A | Marine-derived micromonospora chalcea SCSIO 01819, enzyme preparation liquor, and preparation method and application for enzyme preparation liquor | SOUTH CHINA SEA INST OCEANOLOG | 2015-09-09 | — | — | CN | disclosed |
| WO-2015058115-A1 | STRUCTURED TRIACYLGLYCEROLS AND METHODS FOR MAKING THE SAME | UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) | 2015-04-23 | — | — | WO | disclosed |
| US-4883684-A | SHORTENING CONTAINING MIXTURE OF TRIGLYCERIDES | THE PROCTER & GAMBLE COMPANY (US) | 1989-11-28 | — | — | US | disclosed |
| US-4832975-A | REDUCED CALORIE FATS FOR COOKING OILS | THE PROCTER & GAMBLE COMPANY (US) | 1989-05-23 | — | — | US | disclosed |
| EP-0311167-A2 | Tailored triglycerides having improved autoignition characteristics | THE PROCTER & GAMBLE COMPANY (US) | 1989-04-12 | — | — | EP | disclosed |
| EP-0301861-A1 | Cell proliferation inhibitors | Takeda Chemical Industries, Ltd. (JP) | 1989-02-01 | — | — | EP | disclosed |
| EP-0128374-B1 | PREVENTIVE AND HEALING COMPOSITION FOR DISEASES DUE TO LIPOXYGENASE METABOLIC PRODUCTS | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1988-11-23 | — | — | EP | disclosed |
| US-4618613-A | Preventive and healing composition for diseases due to lipoxygenase metabolic products | KYOWA HAKKO KOGYO COMPANY, LTD. (JP) | 1986-10-21 | — | — | US | disclosed |
| EP-0128374-A2 | Preventive and healing composition for diseases due to lipoxygenase metabolic products | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1984-12-19 | — | — | EP | disclosed |
| US-4032551-A | SOLVENT EXTRACTION | RESEARCH CORPORATION (US) | 1977-06-28 | — | — | US | disclosed |
| US-3956485-A | NEMATOCIDES | RESEARCH CORPORATION (US) | 1976-05-11 | — | — | US | disclosed |